data_2hf6_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 2hf6 _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 ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.238 0.464 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.4 p -67.29 -33.46 75.35 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.33 128.05 57.96 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 169.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.6 mtpp -86.5 -30.3 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 118.201 -0.904 . . . . 0.0 108.747 174.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.38 167.56 27.09 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 119.222 0.919 . . . . 0.0 111.564 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.2 mt -136.47 131.42 48.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.8 mt -131.82 148.55 52.56 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mt -140.58 120.28 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 173.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 mt -124.15 147.13 48.2 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.69 169.41 11.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 169.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.7 -18.82 56.5 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.18 -23.03 18.71 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.452 1.024 . . . . 0.0 110.865 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.75 7.45 6.13 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.652 1.596 . . . . 0.0 112.435 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -68.01 130.09 41.91 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 119.355 1.578 . . . . 0.0 109.891 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -67.58 94.49 0.42 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.719 1.207 . . . . 0.0 109.838 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.3 mt -71.32 -47.75 54.71 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -147.01 152.44 38.6 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.384 0.674 . . . . 0.0 109.378 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.22 147.04 19.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 169.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.424 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 1.0 OUTLIER -145.41 147.89 32.72 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 169.76 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -136.73 147.23 46.61 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.816 1.646 . . . . 0.0 106.756 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -133.73 8.3 3.85 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.662 1.185 . . . . 0.0 110.929 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -136.12 148.3 48.17 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.725 0.81 . . . . 0.0 111.298 -169.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.84 -9.01 49.01 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.893 1.677 . . . . 0.0 114.002 -172.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 p -62.86 -40.84 98.71 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.093 -1.004 . . . . 0.0 112.136 176.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -141.77 64.96 19.17 Favored Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 118.951 0.796 . . . . 0.0 110.863 -173.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -86.52 -1.32 8.32 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.817 2.345 . . . . 0.0 113.451 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.6 m -134.98 140.21 45.5 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.028 0.931 . . . . 0.0 109.676 -169.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -45.2 -51.06 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 126.353 1.861 . . . . 0.0 113.01 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -59.05 -43.81 91.74 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.481 0.582 . . . . 0.0 111.201 -175.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.45 -33.59 62.96 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -61.38 -48.91 79.08 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.499 0.72 . . . . 0.0 110.15 174.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.36 -35.81 74.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.207 0.912 . . . . 0.0 111.488 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.78 -48.61 73.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -63.45 -38.0 89.45 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.011 0.524 . . . . 0.0 111.123 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.01 -41.63 97.4 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.758 1.623 . . . . 0.0 111.258 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.03 -38.93 79.45 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 121.576 -0.702 . . . . 0.0 110.12 176.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.6 -51.07 68.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.908 -0.568 . . . . 0.0 110.343 169.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.1 mm -53.55 -55.06 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 124.987 1.315 . . . . 0.0 108.001 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -59.41 -48.05 83.13 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.789 0.436 . . . . 0.0 110.898 -175.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -58.65 -45.96 88.2 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.732 -0.605 . . . . 0.0 111.225 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -71.15 -6.1 36.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 117.596 -1.192 . . . . 0.0 113.167 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.7 p -125.11 -37.25 2.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 120.862 1.664 . . . . 0.0 113.479 -169.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -70.17 -0.35 7.67 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 120.321 1.419 . . . . 0.0 112.622 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -123.27 20.58 9.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.769 2.028 . . . . 0.0 110.009 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 98.3 m -138.26 160.06 40.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.083 1.353 . . . . 0.0 109.33 -169.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.21 85.51 4.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.537 1.135 . . . . 0.0 109.627 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 4.0 m -46.8 139.28 5.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.402 1.881 . . . . 0.0 115.779 -170.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 152.02 -37.49 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.321 1 C-N-CA 132.387 4.275 . . . . 0.0 107.521 170.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.31 155.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.462 1.105 . . . . 0.0 109.306 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.0 173.88 13.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.47 1.908 . . . . 0.0 108.324 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.0 tp -139.29 115.6 10.46 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.089 -2.189 . . . . 0.0 105.089 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.79 143.26 29.57 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.859 0.864 . . . . 0.0 109.848 -169.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 50.33 26.1 2.13 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.816 1.246 . . . . 0.0 112.721 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.68 9.98 82.18 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.054 1.312 . . . . 0.0 114.112 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.4 mt -123.81 130.88 53.32 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 126.093 1.757 . . . . 0.0 109.718 -172.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 m -74.49 142.19 44.85 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.88 132.61 34.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -101.61 149.84 6.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 33.5 p90 -154.67 163.83 39.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.575 0.702 . . . . 0.0 111.859 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -150.95 155.98 40.23 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.901 2.08 . . . . 0.0 106.184 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 m -140.06 143.94 36.59 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.4 m -145.16 128.58 16.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.795 0.838 . . . . 0.0 110.589 169.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.3 mt 57.59 -69.27 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 128.089 2.556 . . . . 0.0 114.783 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -146.09 19.84 1.41 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.208 2.203 . . . . 0.0 109.327 -171.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -138.73 147.01 42.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.471 1.508 . . . . 0.0 110.558 -168.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -132.97 141.35 48.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.694 1.598 . . . . 0.0 106.97 169.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -128.35 136.83 51.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.9 1.68 . . . . 0.0 107.038 -172.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -143.14 145.84 33.19 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.116 0.871 . . . . 0.0 110.478 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.8 t -136.74 127.88 41.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.72 136.15 59.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -157.87 -173.72 26.65 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 121.942 0.746 . . . . 0.0 112.394 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -67.84 171.22 6.85 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 113.824 -1.188 . . . . 0.0 110.041 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.3 m -130.21 28.52 4.99 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.465 1.106 . . . . 0.0 110.512 -171.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -59.24 -52.41 65.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.508 0.723 . . . . 0.0 112.324 -169.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -148.62 -12.87 0.34 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -153.28 164.96 37.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.788 1.176 . . . . 0.0 111.615 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.23 -3.58 5.61 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 127.699 2.4 . . . . 0.0 110.243 174.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.43 -32.96 74.8 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.37 1.068 . . . . 0.0 110.976 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.6 ptt? -64.05 -33.66 76.25 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.901 0.773 . . . . 0.0 111.638 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.7 mt -71.25 -45.99 62.0 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 10.1 mmt -54.67 -41.18 69.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.288 0.635 . . . . 0.0 110.433 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.43 -51.05 67.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 118.794 0.724 . . . . 0.0 110.129 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 53.3 t -62.29 -44.27 98.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 118.89 -0.576 . . . . 0.0 110.004 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 63.2 tp -62.09 -45.31 94.09 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.875 0.762 . . . . 0.0 110.781 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.5 t -59.51 -46.05 89.95 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.66 -51.52 66.9 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.604 1.161 . . . . 0.0 111.861 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -64.61 -40.82 96.18 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.183 -0.323 . . . . 0.0 110.65 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -75.15 -38.37 60.98 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.344 -0.848 . . . . 0.0 111.534 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 21.9 p -63.99 -41.33 97.54 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 119.352 0.978 . . . . 0.0 110.686 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.8 mt -53.88 -51.02 64.99 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 169.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.6 m -54.83 -36.53 65.1 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 118.633 -0.698 . . . . 0.0 112.008 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -72.5 -51.34 20.47 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.516 1.053 . . . . 0.0 111.634 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 58.5 mtm -69.16 -41.02 77.83 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.035 0.834 . . . . 0.0 110.298 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.8 mp -74.16 -31.41 62.69 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.775 0.83 . . . . 0.0 110.27 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 42.77 45.93 4.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.466 1.907 . . . . 0.0 111.258 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mmmt -145.9 -176.32 5.09 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 128.667 2.787 . . . . 0.0 106.868 -173.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.4 17.8 2.02 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.678 0.791 . . . . 0.0 111.396 -175.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.315 5.8 m 45.26 39.12 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 126.948 2.099 . . . . 0.0 111.949 -173.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -78.17 174.17 11.46 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.64 1.176 . . . . 0.0 110.897 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -50.66 67.73 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.066 0.946 . . . . 0.0 112.475 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -65.63 -38.71 90.17 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.199 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.84 -39.76 92.94 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.9 0.773 . . . . 0.0 110.624 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.26 -46.08 78.29 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.737 0.699 . . . . 0.0 111.047 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.9 tp -58.15 -38.64 76.99 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.966 0.507 . . . . 0.0 110.946 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -68.46 -16.97 64.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.251 1.02 . . . . 0.0 113.137 176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -132.52 22.51 4.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.295 0.952 . . . . 0.0 112.214 -169.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -45.0 -45.69 10.77 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.133 1.373 . . . . 0.0 111.905 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.34 -42.35 96.31 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.005 0.82 . . . . 0.0 111.371 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.33 -44.29 98.26 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.3 tp -57.46 -51.04 71.05 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.218 1.007 . . . . 0.0 110.709 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -56.21 -47.32 78.63 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.347 0.521 . . . . 0.0 109.773 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.8 mt -69.63 -30.78 68.58 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.043 -0.503 . . . . 0.0 111.781 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.92 -46.4 78.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.131 0.878 . . . . 0.0 109.706 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.6 t -57.87 -40.65 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.449 0.568 . . . . 0.0 109.77 176.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -63.0 -8.35 7.11 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.28 1.432 . . . . 0.0 113.905 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.27 -31.67 5.9 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.686 1.195 . . . . 0.0 111.723 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 72.6 mt -66.27 -41.08 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 109.085 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.5 m -140.38 160.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.327 1.051 . . . . 0.0 109.875 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -148.6 127.57 12.73 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.197 1.399 . . . . 0.0 107.671 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.16 31.53 56.35 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.34 -0.7 . . . . 0.0 113.434 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.6 11.21 85.5 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.2 1.0 . . . . 0.0 113.823 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -117.61 137.27 52.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 pt -55.14 138.03 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.321 0.581 . . . . 0.0 110.33 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -126.11 -39.97 2.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.41 1.484 . . . . 0.0 108.838 -172.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -145.26 150.82 37.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.57 0.623 . . . . 0.0 109.386 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.4 m -135.05 24.63 3.58 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.902 1.281 . . . . 0.0 111.144 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -128.71 118.77 19.97 Favored Pre-proline 0 C--O 1.236 0.375 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.19 -42.57 2.86 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 121.743 1.629 . . . . 0.0 112.255 -169.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.3 pp0? -70.51 -26.06 63.42 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.555 1.07 . . . . 0.0 110.776 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.41 -45.08 70.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.652 1.115 . . . . 0.0 109.975 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 16.6 t -52.6 -48.91 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 79.6 t -60.9 -41.53 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-O 118.201 -0.905 . . . . 0.0 111.014 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -57.62 -46.9 83.54 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.618 1.099 . . . . 0.0 109.448 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -65.14 -40.3 94.24 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.638 -0.664 . . . . 0.0 111.466 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 96.6 t -63.81 -43.55 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 118.811 0.732 . . . . 0.0 109.555 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.93 -35.74 80.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.02 0.528 . . . . 0.0 111.086 -178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.0 mt -76.66 -28.39 55.97 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.706 1.202 . . . . 0.0 112.519 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 . . . . . 0 C--O 1.25 1.086 0 CA-C-N 118.921 0.782 . . . . 0.0 110.187 172.365 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.234 0.265 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.6 p -71.78 -42.5 67.06 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 81.4 t -123.07 118.59 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -83.39 -33.99 25.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.13 175.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.89 167.27 24.97 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.412 1.005 . . . . 0.0 111.255 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -135.4 133.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 mt -132.98 146.77 52.07 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 54.2 mt -136.67 116.31 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.79 147.9 47.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.593 0.711 . . . . 0.0 110.486 -169.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.404 ' C ' ' H ' ' A' ' 22' ' ' ASP . 3.8 t0 -66.35 171.64 4.67 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.882 169.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 21.18 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.857 2.063 . . . . 0.0 114.111 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 20' ' ' ASP . 37.5 t70 -136.45 11.48 3.23 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.469 1.908 . . . . 0.0 110.602 172.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.98 35.51 71.95 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 120.825 -1.172 . . . . 0.0 111.296 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -104.23 132.53 50.38 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.421 1.111 . . . . 0.0 109.29 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -58.87 114.88 2.76 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.834 0.854 . . . . 0.0 110.404 -174.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.5 mt -91.17 -42.66 10.32 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 156.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -145.47 149.03 33.92 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 169.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.12 144.25 12.8 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 168.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? -145.67 147.19 31.72 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.066 1.346 . . . . 0.0 107.689 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -132.19 150.44 52.15 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.834 1.654 . . . . 0.0 107.272 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -133.59 9.61 3.97 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.332 1.453 . . . . 0.0 110.597 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -129.2 150.18 50.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.283 1.433 . . . . 0.0 108.871 -169.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.16 -1.32 56.76 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.215 1.006 . . . . 0.0 112.98 -169.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 m -70.47 -34.32 72.26 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.683 0.674 . . . . 0.0 110.763 175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -140.56 67.23 30.05 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.058 0.943 . . . . 0.0 110.133 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -90.15 -2.71 5.42 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.705 2.27 . . . . 0.0 113.458 -174.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.4 m -135.45 145.75 47.52 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.003 0.921 . . . . 0.0 109.757 -169.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.5 t -45.54 -52.35 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 126.178 1.791 . . . . 0.0 113.036 -169.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.53 -45.5 88.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.755 0.707 . . . . 0.0 111.06 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.4 -35.06 65.8 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -177.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -61.12 -50.21 74.12 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.772 0.829 . . . . 0.0 110.047 174.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -60.14 -36.21 77.02 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.282 -0.886 . . . . 0.0 111.385 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.05 -47.64 76.63 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.09 0.556 . . . . 0.0 109.65 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -61.47 -37.66 84.43 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.432 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.2 -37.34 87.0 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.188 1.395 . . . . 0.0 112.042 176.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.92 -47.45 80.5 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.394 0.997 . . . . 0.0 109.236 172.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.31 -50.95 66.17 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.366 0.417 . . . . 0.0 110.551 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.5 -55.66 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 125.408 1.483 . . . . 0.0 108.415 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -66.8 -43.79 82.97 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 117.995 0.361 . . . . 0.0 110.782 -172.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.93 -50.39 70.86 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.59 0.356 . . . . 0.0 110.31 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.1 mmtm -66.16 -50.18 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 122.278 0.231 . . . . 0.0 110.531 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 38.4 p -70.82 -35.67 72.59 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -168.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.9 p-80 -71.08 -1.42 12.2 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 120.359 1.436 . . . . 0.0 112.266 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -122.72 23.16 9.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.57 1.948 . . . . 0.0 109.726 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.2 m -132.94 160.01 38.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.977 1.711 . . . . 0.0 108.268 -177.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -80.99 28.88 0.35 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.754 1.621 . . . . 0.0 113.282 -169.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 3.9 m 67.69 -177.62 0.21 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.168 1.787 . . . . 0.0 113.725 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 10.6 pt-20 57.91 -46.01 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 131.522 3.929 . . . . 0.0 117.078 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.4 tt -152.88 154.64 7.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 120.461 1.482 . . . . 0.0 109.785 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.11 174.08 13.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.65 1.58 . . . . 0.0 109.01 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.37 105.73 6.38 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 178.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.8 mt -127.84 132.56 49.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 52.98 26.58 4.83 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.655 1.182 . . . . 0.0 112.515 176.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 1.74 77.67 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.815 1.198 . . . . 0.0 113.945 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -112.22 142.8 44.26 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 119.381 1.59 . . . . 0.0 110.622 -177.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.9 m -75.12 141.07 43.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 171.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.68 134.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.18 147.3 15.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.193 -1.781 . . . . 0.0 106.193 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 32.5 p90 -156.68 158.57 37.21 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.969 0.414 . . . . 0.0 111.677 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -147.3 175.22 10.94 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.125 0.97 . . . . 0.0 108.383 169.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 p -145.15 149.06 34.31 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.0 m -147.69 147.42 29.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.326 1.05 . . . . 0.0 109.274 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 mp 49.53 -87.65 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 126.937 2.095 . . . . 0.0 112.109 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -145.26 26.0 1.35 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.849 2.06 . . . . 0.0 109.277 -176.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.3 tp -131.23 147.43 52.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.388 1.875 . . . . 0.0 109.347 -169.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -126.41 145.18 50.57 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.3 139.81 49.65 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.454 1.502 . . . . 0.0 107.422 -172.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -146.24 147.86 31.87 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.824 0.85 . . . . 0.0 111.029 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 93.5 t -135.68 127.82 46.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 169.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mm -114.63 135.83 53.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -171.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.19 173.64 32.01 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.84 1.244 . . . . 0.0 112.019 -172.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -68.96 167.92 14.8 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.13 -1.535 . . . . 0.0 111.139 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.0 m -61.14 -46.97 88.39 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 170.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 10.3 t80 50.23 -167.11 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.048 2.139 . . . . 0.0 112.084 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -83.83 -14.91 50.11 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.589 -0.694 . . . . 0.0 111.405 171.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -161.19 163.13 31.37 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 124.89 1.276 . . . . 0.0 110.398 -172.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.09 -6.39 10.91 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.858 2.463 . . . . 0.0 110.452 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.17 -32.76 72.5 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 124.947 1.299 . . . . 0.0 110.571 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -64.06 -33.33 75.5 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.847 0.749 . . . . 0.0 111.601 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.4 mt -72.64 -44.24 62.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.6 mmt -54.33 -42.01 69.71 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.374 172.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -48.49 77.43 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.542 0.737 . . . . 0.0 110.236 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.93 -44.67 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.018 0.527 . . . . 0.0 110.277 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 47.3 tp -60.39 -51.84 67.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 118.618 0.645 . . . . 0.0 110.035 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -71.55 -31.83 67.45 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 118.584 -0.722 . . . . 0.0 110.989 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.76 -49.63 76.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.082 0.855 . . . . 0.0 109.659 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.72 -46.12 89.57 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.739 0.699 . . . . 0.0 110.709 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.74 -43.57 98.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.013 0.525 . . . . 0.0 111.346 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.73 -36.61 67.8 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 121.432 -0.792 . . . . 0.0 110.886 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.7 m -63.62 -44.15 94.77 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.765 0.711 . . . . 0.0 110.927 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.5 mt -52.26 -53.62 41.56 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.0 m -55.84 -40.42 72.83 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.412 0.445 . . . . 0.0 111.565 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -67.64 -43.75 79.58 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.999 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 12.5 ptt? -83.37 -29.05 28.52 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.59 1.086 . . . . 0.0 112.312 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.3 tp -88.79 -33.48 17.42 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.2 0.6 . . . . 0.0 112.24 -169.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 49.96 33.09 6.24 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.936 1.694 . . . . 0.0 114.132 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -153.1 -174.93 5.11 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.909 1.684 . . . . 0.0 106.908 169.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -48.19 125.77 9.87 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 m -78.01 45.13 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.616 1.166 . . . . 0.0 109.322 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -80.4 163.85 23.53 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.751 0.82 . . . . 0.0 109.994 176.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -59.11 -36.52 75.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -169.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.0 tpp85 -65.4 -42.02 93.03 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.013 0.824 . . . . 0.0 110.138 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.58 -33.41 74.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.478 0.581 . . . . 0.0 110.787 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.5 -44.59 86.53 Favored 'General case' 0 N--CA 1.461 0.094 0 O-C-N 121.404 -0.81 . . . . 0.0 110.905 171.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.79 -38.38 72.43 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.435 0.694 . . . . 0.0 110.862 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.29 -21.99 65.66 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.24 27.27 5.37 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.466 1.03 . . . . 0.0 112.977 -175.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -40.88 -48.47 3.12 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 125.666 1.586 . . . . 0.0 112.922 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.7 -39.61 94.55 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.985 0.811 . . . . 0.0 111.304 -177.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.13 -43.56 92.99 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -58.22 -51.06 71.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.322 1.049 . . . . 0.0 110.298 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -56.29 -46.03 79.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.332 0.653 . . . . 0.0 109.961 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.85 -40.41 91.68 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-O 118.885 -0.579 . . . . 0.0 111.372 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.76 -46.45 90.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.93 0.786 . . . . 0.0 109.694 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.6 -46.47 86.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.302 0.501 . . . . 0.0 109.904 175.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.46 -21.83 66.53 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 112.936 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -92.01 -28.72 17.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.895 0.878 . . . . 0.0 110.656 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.1 mt -80.06 -37.46 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 118.967 0.803 . . . . 0.0 109.525 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 20.6 t -140.14 143.67 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.308 1.043 . . . . 0.0 108.923 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -145.69 134.55 22.45 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.584 1.154 . . . . 0.0 107.982 169.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.82 29.46 54.89 Favored Glycine 0 CA--C 1.533 1.156 0 CA-C-O 119.537 -0.591 . . . . 0.0 112.965 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.33 14.38 79.3 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 117.98 0.89 . . . . 0.0 113.949 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 26.6 t -120.04 135.54 60.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 24.1 pt -60.96 157.38 2.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-O 121.141 0.496 . . . . 0.0 110.411 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.5 mt -118.18 -48.48 2.53 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 124.272 1.029 . . . . 0.0 108.765 173.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -157.14 156.54 32.86 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.153 1.381 . . . . 0.0 107.563 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.4 p -140.44 17.26 2.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.986 0.914 . . . . 0.0 111.801 -174.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.66 114.96 63.09 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 169.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.38 -32.84 31.52 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.968 1.779 . . . . 0.0 113.025 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.15 -48.84 74.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.696 0.68 . . . . 0.0 109.183 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -66.22 -40.93 90.65 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.347 -0.846 . . . . 0.0 109.948 -175.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -56.75 -57.07 10.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 123.866 0.866 . . . . 0.0 109.509 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.23 -39.63 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.406 0.548 . . . . 0.0 110.466 -172.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -63.04 -44.05 96.97 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.637 0.653 . . . . 0.0 110.311 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -61.09 -46.24 91.45 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.672 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.68 -27.23 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 119.606 1.094 . . . . 0.0 111.881 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.53 -38.83 74.28 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.858 0.753 . . . . 0.0 111.281 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 49.1 mt -71.01 -38.54 72.63 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.827 0.851 . . . . 0.0 110.944 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.246 176.43 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.9 p -68.85 -36.01 77.62 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -135.52 142.8 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 169.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -98.76 -25.82 14.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 117.636 -1.174 . . . . 0.0 109.978 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.19 166.49 29.59 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.672 1.123 . . . . 0.0 112.059 174.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.95 133.06 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 104.654 -2.35 . . . . 0.0 104.654 172.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.6 mt -135.09 149.96 50.15 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.8 mt -138.91 124.22 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.532 -2.395 . . . . 0.0 104.532 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.9 mt -121.47 147.95 45.08 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -173.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.23 168.15 12.88 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.552 0.692 . . . . 0.0 109.727 169.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -55.11 -20.49 10.13 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.0 0.83 30.38 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.62 1.1 . . . . 0.0 111.494 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.06 17.44 43.56 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.953 1.263 . . . . 0.0 112.771 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.89 137.93 39.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.305 1.552 . . . . 0.0 109.878 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -60.33 120.62 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 175.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.2 mt -97.67 -44.53 6.73 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 163.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -145.23 151.3 38.18 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.123 173.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.51 144.69 15.6 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 169.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.428 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -147.51 148.97 31.76 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.77 1.228 . . . . 0.0 107.856 171.877 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -136.88 148.1 46.87 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.779 1.631 . . . . 0.0 106.925 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -133.89 2.55 3.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.973 0.909 . . . . 0.0 111.568 -174.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -132.9 159.2 40.59 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.011 0.925 . . . . 0.0 108.991 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.87 5.57 3.16 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.274 2.23 . . . . 0.0 112.51 -174.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -61.62 -48.16 82.15 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.938 1.295 . . . . 0.0 110.58 177.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -143.9 73.69 16.6 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.533 1.133 . . . . 0.0 108.542 -177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.41 -0.69 6.02 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.654 2.236 . . . . 0.0 113.521 -171.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 m -135.04 139.78 45.08 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.061 0.944 . . . . 0.0 109.459 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -43.58 -53.04 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.607 1.963 . . . . 0.0 113.043 -169.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -62.51 -43.54 98.55 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.387 0.539 . . . . 0.0 111.115 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -68.93 -35.66 77.05 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -63.78 -50.97 66.91 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.367 0.667 . . . . 0.0 110.558 176.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.62 -37.64 73.63 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.398 -0.814 . . . . 0.0 110.877 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.21 -45.56 80.34 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -61.99 -37.95 86.76 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.101 0.56 . . . . 0.0 110.897 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.99 -42.17 97.29 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.751 1.62 . . . . 0.0 111.181 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -66.01 -42.26 89.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.472 -0.768 . . . . 0.0 109.919 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.55 -46.77 77.07 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.068 0.547 . . . . 0.0 110.849 173.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.9 mm -56.5 -54.95 22.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 C-N-CA 124.673 1.189 . . . . 0.0 108.301 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -60.14 -48.8 80.22 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.188 0.449 . . . . 0.0 110.842 -177.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -58.91 -39.76 82.49 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.549 1.14 . . . . 0.0 112.126 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -76.92 -47.49 20.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.135 0.574 . . . . 0.0 109.956 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.9 p -70.53 -26.81 63.74 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.454 -0.779 . . . . 0.0 112.403 -169.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -73.87 5.35 4.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.077 1.308 . . . . 0.0 112.428 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.08 14.09 9.79 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.309 1.844 . . . . 0.0 110.723 175.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.6 m -120.69 162.93 18.85 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.379 1.072 . . . . 0.0 109.318 -171.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -88.59 23.11 2.36 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.371 1.468 . . . . 0.0 112.992 -169.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.4 m 68.64 179.79 0.23 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 0.0 113.848 175.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.31 10.5 pt-20 56.94 -50.95 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 131.275 3.83 . . . . 0.0 116.13 -175.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.0 tt -151.54 155.29 7.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 120.377 1.444 . . . . 0.0 110.062 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.28 164.83 35.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.405 1.882 . . . . 0.0 109.23 -177.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.09 106.92 8.94 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 102.442 -3.17 . . . . 0.0 102.442 170.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mp -81.01 -64.51 1.17 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -168.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -139.8 7.15 2.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.592 1.557 . . . . 0.0 110.844 -172.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 144.84 -38.82 1.25 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 126.04 1.781 . . . . 0.0 109.383 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -80.01 139.44 36.97 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.137 0.975 . . . . 0.0 110.463 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 62.1 m -85.22 141.19 30.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.931 1.292 . . . . 0.0 107.556 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 93.7 t -138.19 131.3 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 106.338 -1.726 . . . . 0.0 106.338 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.6 m -107.91 145.29 15.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 169.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -156.86 159.19 37.95 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.93 0.395 . . . . 0.0 111.721 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -150.4 171.02 17.68 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.369 1.067 . . . . 0.0 108.562 170.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -143.71 140.89 30.24 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 m -146.77 142.07 27.37 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.541 0.737 . . . . 0.0 109.581 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 53.79 -85.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 127.176 2.191 . . . . 0.0 112.328 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -146.6 29.57 1.02 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.269 1.827 . . . . 0.0 108.911 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.0 tp -137.43 147.24 45.23 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.257 1.823 . . . . 0.0 109.446 -169.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -129.55 139.26 51.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -127.19 140.48 52.21 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.624 1.57 . . . . 0.0 107.938 -172.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -146.31 149.17 33.31 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.161 0.984 . . . . 0.0 111.396 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 86.0 t -140.6 140.76 33.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -130.82 134.99 61.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 -171.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.17 172.1 37.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-O 121.942 0.745 . . . . 0.0 113.065 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.4 m -63.08 129.27 39.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.207 1.403 . . . . 0.0 109.999 -173.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -77.01 33.45 0.15 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.204 1.802 . . . . 0.0 113.48 -172.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.08 169.57 8.25 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.21 1.004 . . . . 0.0 109.166 169.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.43 26.62 0.05 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.115 1.766 . . . . 0.0 113.484 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -138.09 46.78 2.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 125.785 1.634 . . . . 0.0 109.124 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -55.84 -14.97 2.7 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.439 -0.788 . . . . 0.0 111.603 169.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -51.12 -35.63 36.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.587 1.955 . . . . 0.0 111.213 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.1 ptt? -71.5 -32.77 68.6 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.566 1.076 . . . . 0.0 111.614 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.43 -48.2 73.56 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.21 -41.67 79.87 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 122.485 0.314 . . . . 0.0 110.341 178.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.26 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.737 0.815 . . . . 0.0 110.319 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.3 t -61.99 -44.38 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.077 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.91 -49.62 76.74 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.724 0.693 . . . . 0.0 110.493 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -63.34 -41.61 98.88 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 119.559 -0.258 . . . . 0.0 110.482 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.2 t -60.92 -49.98 75.26 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.193 0.597 . . . . 0.0 109.621 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.14 -45.66 90.87 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -60.69 -47.92 84.09 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.58 -36.52 78.84 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.75 -0.594 . . . . 0.0 111.409 -177.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 61.2 m -59.04 -48.2 82.46 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.748 0.819 . . . . 0.0 110.631 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 36.2 mt -53.82 -50.71 65.57 Favored 'General case' 0 C--N 1.342 0.264 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 174.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.6 m -55.77 -37.91 69.18 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.677 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -70.81 -55.71 7.94 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.169 1.349 . . . . 0.0 110.141 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -74.25 -29.85 61.87 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.821 -170.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 16.2 tp -88.71 -34.72 17.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.107 0.563 . . . . 0.0 111.388 -174.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.289 0.0 OUTLIER 41.04 48.82 2.96 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.887 1.675 . . . . 0.0 112.684 -173.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -136.83 179.63 6.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.043 2.137 . . . . 0.0 106.402 169.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -70.53 14.67 0.12 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.278 25.3 m 44.49 40.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 127.122 2.169 . . . . 0.0 112.142 -173.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.15 165.72 24.51 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.391 0.677 . . . . 0.0 111.093 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -46.37 -51.61 14.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.429 1.892 . . . . 0.0 112.904 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -67.29 -41.38 85.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.139 0.427 . . . . 0.0 110.275 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.45 -34.96 79.42 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.646 -0.659 . . . . 0.0 110.523 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.5 mp -64.87 -46.97 79.56 Favored 'General case' 0 CA--C 1.521 -0.172 0 O-C-N 121.269 -0.894 . . . . 0.0 110.895 172.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.7 tp -55.2 -37.16 66.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.404 0.682 . . . . 0.0 111.081 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -70.37 -18.81 63.06 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.43 25.14 4.46 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.649 1.113 . . . . 0.0 113.014 -174.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -41.21 -47.35 3.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.467 1.507 . . . . 0.0 112.419 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.92 -39.43 94.16 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.037 0.835 . . . . 0.0 111.903 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.06 -43.75 98.34 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.2 tp -57.95 -49.37 77.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.977 0.911 . . . . 0.0 110.684 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -55.83 -47.63 76.89 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.483 0.583 . . . . 0.0 109.61 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.2 mt -67.57 -35.91 79.92 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.291 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.8 90.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.732 0.696 . . . . 0.0 109.85 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.6 t -57.44 -43.84 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 118.801 0.728 . . . . 0.0 109.648 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.07 3.82 3.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.139 0.976 . . . . 0.0 113.611 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -120.34 -27.13 5.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.605 1.562 . . . . 0.0 110.988 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.97 -39.7 77.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.255 0.934 . . . . 0.0 108.851 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.23 157.93 43.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.837 0.827 . . . . 0.0 110.738 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -145.62 130.1 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.951 1.7 . . . . 0.0 106.744 169.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.65 32.42 53.95 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.377 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.59 19.82 76.72 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.377 1.088 . . . . 0.0 113.662 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 72.4 t -124.64 139.56 50.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 174.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.18 135.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.346 0.593 . . . . 0.0 110.092 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -116.82 -42.24 2.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.714 1.606 . . . . 0.0 108.354 -173.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -147.86 152.1 37.05 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -131.5 -12.68 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.693 1.197 . . . . 0.0 111.428 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.76 117.04 62.07 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.337 0.971 . . . . 0.0 108.638 169.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.36 -31.68 27.66 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.24 1.96 . . . . 0.0 112.152 -172.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -44.38 85.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.614 -0.679 . . . . 0.0 109.319 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.89 -38.79 92.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.635 0.652 . . . . 0.0 110.544 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.6 t -56.71 -52.31 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 118.86 0.754 . . . . 0.0 109.366 173.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.9 t -63.14 -38.53 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.966 0.803 . . . . 0.0 110.499 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.2 -39.75 93.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.153 0.888 . . . . 0.0 110.822 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -64.34 -46.01 85.33 Favored 'General case' 0 CA--C 1.526 0.034 0 CA-C-N 118.723 0.692 . . . . 0.0 110.543 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.96 -40.69 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 118.904 0.774 . . . . 0.0 109.618 177.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.04 -33.74 72.35 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.569 0.748 . . . . 0.0 112.1 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 30.9 mt -72.64 -32.7 66.1 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.062 0.945 . . . . 0.0 111.936 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 . . . . . 0 C--O 1.25 1.088 0 CA-C-N 118.336 0.517 . . . . 0.0 109.898 178.08 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 . . . . . 0 C--O 1.235 0.339 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.1 p -74.7 -34.81 62.7 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.9 t -132.03 139.98 49.01 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -106.85 -30.11 9.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.705 176.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.19 167.48 26.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.83 1.196 . . . . 0.0 111.847 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.5 mt -139.45 135.22 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 172.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.15 154.6 49.17 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.7 mt -139.61 120.42 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.669 -2.715 . . . . 0.0 103.669 169.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.12 143.57 48.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.613 0.765 . . . . 0.0 109.459 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -67.61 168.74 10.56 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 168.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -14.71 61.96 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.1 0.96 . . . . 0.0 112.244 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -74.63 -9.52 58.65 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.139 0.975 . . . . 0.0 112.207 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.24 52.89 9.8 Favored Glycine 0 C--N 1.341 0.849 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -172.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -136.92 131.44 33.07 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.633 1.173 . . . . 0.0 109.306 -173.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -59.66 107.23 0.57 Allowed 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.868 0.867 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 mt -73.83 -37.34 64.88 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 155.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -143.2 148.92 37.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.615 1.566 . . . . 0.0 107.851 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.89 141.89 10.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.4 OUTLIER -149.35 148.28 29.32 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.607 1.563 . . . . 0.0 107.714 176.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.43 152.24 46.9 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.711 1.604 . . . . 0.0 108.056 -173.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -136.12 -4.21 2.17 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.214 1.005 . . . . 0.0 112.581 -174.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -134.2 158.53 43.47 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.12 0.873 . . . . 0.0 110.037 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.4 2.05 6.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.144 2.177 . . . . 0.0 112.747 -172.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 p -59.71 -48.44 81.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.65 1.18 . . . . 0.0 110.431 174.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -145.16 75.61 13.85 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.5 1.12 . . . . 0.0 108.704 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -90.36 -0.99 5.38 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.714 2.276 . . . . 0.0 113.695 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -135.51 140.13 44.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 119.14 0.882 . . . . 0.0 109.943 -169.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.3 t -45.41 -50.4 3.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.532 1.933 . . . . 0.0 113.062 -169.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -57.9 -48.72 79.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.545 0.611 . . . . 0.0 110.927 -176.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.91 -35.13 72.15 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -63.29 -51.2 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.592 0.757 . . . . 0.0 110.924 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -62.01 -32.61 73.11 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.026 -1.046 . . . . 0.0 111.246 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.88 71.77 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.3 -38.96 88.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.998 0.919 . . . . 0.0 111.513 178.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -61.0 -48.96 79.4 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.046 1.738 . . . . 0.0 110.59 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -68.76 -35.43 77.07 Favored 'General case' 0 N--CA 1.463 0.175 0 O-C-N 121.75 -0.594 . . . . 0.0 110.903 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -47.83 76.9 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.536 0.734 . . . . 0.0 110.553 169.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.4 mt -61.56 -47.34 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.278 0.631 . . . . 0.0 109.703 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -60.42 -47.09 87.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.631 0.65 . . . . 0.0 109.961 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -54.58 -48.02 72.61 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.059 0.943 . . . . 0.0 111.524 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.8 mmmt -69.97 -49.36 52.47 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.306 0.642 . . . . 0.0 110.016 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 39.2 p -70.3 -27.46 64.41 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.638 -0.664 . . . . 0.0 111.818 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -62.14 -17.96 59.46 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.895 0.77 . . . . 0.0 111.943 170.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -117.59 25.04 10.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.313 1.845 . . . . 0.0 110.036 -175.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.8 m -132.55 158.22 42.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.841 1.656 . . . . 0.0 107.608 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.82 -41.8 98.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.1 m 141.89 -174.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 1 C-N-CA 132.531 4.332 . . . . 0.0 108.633 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.335 10.1 pt-20 61.08 -47.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 131.366 3.866 . . . . 0.0 116.859 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.61 152.54 10.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 120.198 1.363 . . . . 0.0 109.871 -175.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.79 165.18 31.33 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.404 1.882 . . . . 0.0 108.72 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -134.42 104.42 6.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 103.132 -2.914 . . . . 0.0 103.132 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -67.48 -63.09 1.13 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.358 -169.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -149.34 1.75 0.54 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.394 2.278 . . . . 0.0 110.308 -174.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.39 -35.95 1.21 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.03 1.776 . . . . 0.0 109.962 -171.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.0 mt -72.07 125.35 27.05 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 170.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 m -82.04 141.57 33.08 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.6 t -131.23 137.18 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.96 135.87 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -157.85 171.17 20.78 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.593 0.711 . . . . 0.0 112.072 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.9 tttp -153.94 157.08 38.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.026 1.73 . . . . 0.0 106.788 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -137.71 133.07 33.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -152.98 144.03 23.03 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.152 0.581 . . . . 0.0 110.401 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 mt 65.0 -84.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.403 1.881 . . . . 0.0 109.475 173.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -150.82 21.07 0.79 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.818 1.647 . . . . 0.0 109.52 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.9 tp -125.77 147.25 49.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 126.787 2.035 . . . . 0.0 110.144 -168.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -129.38 134.64 47.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -123.75 138.62 54.48 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.148 1.379 . . . . 0.0 107.501 -169.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -144.8 150.3 36.93 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.643 1.11 . . . . 0.0 112.099 -170.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.0 t -137.26 140.7 41.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 127.441 2.296 . . . . 0.0 104.953 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -131.14 135.87 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 -177.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.47 175.74 30.97 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-O 122.802 1.223 . . . . 0.0 112.502 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.9 m -61.21 154.17 24.16 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 112.599 -1.8 . . . . 0.0 110.639 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.4 m -57.01 -39.11 74.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.327 0.651 . . . . 0.0 109.881 171.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 5.9 t80 48.98 -143.59 0.48 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.689 1.996 . . . . 0.0 110.683 169.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.47 6.73 6.31 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.157 1.383 . . . . 0.0 111.625 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -159.19 163.19 36.21 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.489 1.516 . . . . 0.0 109.049 174.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -120.89 -6.87 9.56 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.436 2.294 . . . . 0.0 110.472 175.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.2 mt -57.17 -35.33 69.43 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 125.832 1.653 . . . . 0.0 110.655 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -65.06 -34.16 77.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.582 0.628 . . . . 0.0 111.912 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -73.51 -40.88 63.7 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.8 -45.57 70.8 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.982 . . . . 0.0 110.373 169.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.41 75.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.257 1.023 . . . . 0.0 110.387 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.5 t -61.34 -44.56 98.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 C-N-CA 123.3 0.64 . . . . 0.0 110.006 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.4 tp -60.15 -48.99 79.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.2 0.455 . . . . 0.0 110.274 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -61.37 -44.82 96.51 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 119.47 -0.3 . . . . 0.0 110.4 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 94.6 m -62.5 -45.53 92.57 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 118.885 -0.579 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.6 tp -65.95 -46.19 79.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.195 0.907 . . . . 0.0 110.819 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -64.16 -41.99 96.92 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 117.981 0.355 . . . . 0.0 110.799 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.76 -39.55 84.14 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.571 -0.705 . . . . 0.0 110.801 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.1 m -59.8 -48.05 83.25 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.323 0.649 . . . . 0.0 110.734 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -52.88 -48.86 66.83 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -60.24 -27.13 66.96 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.355 -0.831 . . . . 0.0 113.028 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.5 mm-40 -81.9 -53.33 6.25 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 120.12 1.327 . . . . 0.0 110.771 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -78.75 -33.79 46.27 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -168.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.56 -43.87 68.58 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.304 0.956 . . . . 0.0 109.104 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? 49.61 51.53 16.28 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.817 1.247 . . . . 0.0 110.048 -169.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -137.49 -171.37 2.96 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.762 2.425 . . . . 0.0 106.875 176.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -77.38 5.84 8.0 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.273 0.629 . . . . 0.0 112.113 175.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.324 4.8 m 49.2 40.34 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 126.91 2.084 . . . . 0.0 112.204 -174.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.27 168.83 18.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.128 0.971 . . . . 0.0 110.205 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -49.16 -48.23 45.1 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.605 1.162 . . . . 0.0 112.591 -176.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -66.4 -39.95 89.33 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 118.644 -0.694 . . . . 0.0 110.341 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.34 -36.88 85.17 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.201 0.91 . . . . 0.0 110.487 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.99 -47.06 78.89 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.769 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.3 tp -56.67 -38.06 71.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.69 0.677 . . . . 0.0 111.331 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.62 -19.08 64.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.03 0.932 . . . . 0.0 112.887 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -131.75 24.77 4.69 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.105 0.962 . . . . 0.0 111.561 -169.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -47.88 -47.66 31.7 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.917 1.287 . . . . 0.0 111.472 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -66.93 -36.34 82.02 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.241 0.473 . . . . 0.0 111.416 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.44 96.51 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.1 -49.07 79.09 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.685 1.194 . . . . 0.0 111.096 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -54.11 -48.42 70.76 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.983 0.811 . . . . 0.0 110.362 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 71.9 mt -68.43 -34.85 76.73 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.097 -0.478 . . . . 0.0 111.526 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.9 -44.94 83.79 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.925 0.784 . . . . 0.0 109.867 175.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.6 t -56.61 -45.29 82.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.8 -5.92 10.37 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.867 1.267 . . . . 0.0 113.686 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -112.3 -18.39 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 111.774 174.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 80.9 mt -81.4 -41.64 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.487 1.04 . . . . 0.0 108.467 172.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.9 p -145.0 148.11 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.267 1.027 . . . . 0.0 109.003 -169.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -146.89 136.44 22.93 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.8 29.58 50.41 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.928 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.68 14.86 81.69 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 118.171 0.986 . . . . 0.0 113.627 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.72 125.99 73.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.1 pt -57.93 145.72 8.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.3 pp -133.99 -13.33 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.022 0.929 . . . . 0.0 111.875 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -149.14 157.41 43.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.136 0.88 . . . . 0.0 108.964 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.7 p -143.93 31.06 1.28 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.809 1.643 . . . . 0.0 109.96 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -134.63 114.04 12.09 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 125.08 1.352 . . . . 0.0 107.897 178.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.82 -31.49 10.22 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.308 2.005 . . . . 0.0 112.16 -170.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -66.64 -45.38 79.21 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -71.98 -30.55 65.37 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.214 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.6 t -57.07 -54.62 27.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.612 1.096 . . . . 0.0 108.451 169.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.18 -36.18 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 119.159 0.89 . . . . 0.0 111.275 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -55.77 -49.82 72.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.134 0.879 . . . . 0.0 109.989 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -63.01 -40.66 98.44 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.407 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 69.3 t -59.37 -43.54 90.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.778 1.172 . . . . 0.0 109.935 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.7 75.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.307 0.643 . . . . 0.0 111.674 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.23 -37.39 80.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 125.966 1.706 . . . . 0.0 111.622 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 . . . . . 0 C--O 1.249 1.047 0 C-N-CA 123.999 0.919 . . . . 0.0 109.817 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 . . . . . 0 C--O 1.236 0.366 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 36.1 p -72.35 -31.65 65.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 173.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 m -136.44 139.81 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 123.64 0.776 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -91.94 -36.01 13.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.183 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.27 167.25 24.24 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.239 0.927 . . . . 0.0 112.541 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.7 mt -135.32 135.7 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 104.789 -2.301 . . . . 0.0 104.789 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 mt -133.92 151.93 51.67 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.5 mt -139.72 120.21 14.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 169.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 mt -123.76 144.5 49.65 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -172.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 168.41 9.61 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.401 170.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -71.68 10.46 0.66 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.665 1.186 . . . . 0.0 113.881 -174.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.99 5.17 5.94 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.64 1.576 . . . . 0.0 110.621 169.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 6.02 58.25 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 125.286 1.422 . . . . 0.0 113.203 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -69.83 132.42 46.01 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.426 1.613 . . . . 0.0 109.865 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -60.21 123.75 18.18 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.3 mt -100.11 -41.27 7.2 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 162.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -147.86 152.12 37.08 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.431 0.692 . . . . 0.0 109.6 172.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.08 146.63 18.99 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 169.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -146.39 145.19 30.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 172.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -134.67 148.65 50.39 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 125.621 1.569 . . . . 0.0 106.855 -177.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -130.41 7.14 4.9 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.267 1.027 . . . . 0.0 110.684 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -133.66 147.38 51.42 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.081 0.952 . . . . 0.0 110.674 -170.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.61 -7.51 33.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.163 1.785 . . . . 0.0 114.483 -169.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.9 p -67.04 -35.29 79.57 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.646 1.112 . . . . 0.0 112.618 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -141.36 63.51 17.7 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 119.323 0.965 . . . . 0.0 111.231 -174.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -86.69 -1.39 8.21 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.98 2.454 . . . . 0.0 113.314 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.2 m -134.73 140.49 45.99 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.086 0.955 . . . . 0.0 109.511 -169.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.2 t -44.52 -52.63 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 126.338 1.855 . . . . 0.0 112.955 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.87 -43.24 98.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.683 0.674 . . . . 0.0 111.193 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.57 -33.97 64.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.4 -50.01 75.28 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-O 118.691 -0.671 . . . . 0.0 109.726 172.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -57.52 -37.2 72.64 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.176 0.898 . . . . 0.0 111.405 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.25 -50.13 72.96 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.313 0.645 . . . . 0.0 109.508 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.4 -37.48 87.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.847 0.459 . . . . 0.0 111.578 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.48 -45.74 91.64 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.131 1.772 . . . . 0.0 110.537 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.87 -42.94 97.39 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.903 -0.498 . . . . 0.0 109.993 175.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.0 -49.96 70.2 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.214 0.606 . . . . 0.0 110.888 173.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -58.05 -51.77 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.061 0 C-N-CA 123.974 0.91 . . . . 0.0 108.766 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -60.64 -47.91 84.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.371 0.532 . . . . 0.0 110.702 -174.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -56.65 -50.6 71.57 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 122.889 0.476 . . . . 0.0 110.855 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -64.83 -46.75 80.65 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.3 p -71.03 -32.62 69.42 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.669 -0.644 . . . . 0.0 111.822 -174.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -62.72 -12.73 25.71 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.368 -0.833 . . . . 0.0 111.701 170.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -122.34 25.02 9.12 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.063 1.745 . . . . 0.0 109.754 -175.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 99.2 m -133.06 161.64 33.84 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.834 1.653 . . . . 0.0 108.505 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -87.47 25.34 1.45 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.441 1.496 . . . . 0.0 113.426 -169.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.457 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 7.2 m 69.05 178.92 0.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.79 1.636 . . . . 0.0 113.728 176.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.6 pt-20 55.96 -46.56 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 131.107 3.763 . . . . 0.0 116.706 -174.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.8 tt -149.78 156.81 6.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 120.278 1.399 . . . . 0.0 109.62 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.87 158.29 43.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.479 1.912 . . . . 0.0 108.392 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -121.89 99.24 6.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 101.754 -3.424 . . . . 0.0 101.754 169.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.41 -62.3 1.61 Allowed 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 123.64 0.776 . . . . 0.0 112.217 -168.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -149.44 4.96 0.61 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.582 1.953 . . . . 0.0 110.783 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 142.75 -35.39 1.71 Allowed Glycine 0 CA--C 1.528 0.852 0 C-N-CA 126.353 1.93 . . . . 0.0 108.817 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.35 133.51 47.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.322 1.049 . . . . 0.0 108.418 169.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.3 m -90.2 144.11 26.16 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.6 t -136.54 137.89 47.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.3 m -119.92 146.18 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.457 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 25.7 p90 -157.74 160.27 37.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.091 0.472 . . . . 0.0 110.848 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -148.16 174.59 11.81 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.137 0.975 . . . . 0.0 108.63 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.7 p -140.57 145.46 36.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 171.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -146.79 142.29 27.58 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.69 0.796 . . . . 0.0 109.341 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.6 mp 53.03 -84.29 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.155 2.182 . . . . 0.0 111.454 -174.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -149.85 30.76 0.72 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.415 1.886 . . . . 0.0 109.06 -176.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.6 tp -137.83 148.18 45.22 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.203 1.401 . . . . 0.0 109.774 -169.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -124.9 146.55 49.27 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.926 0.891 . . . . 0.0 108.95 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -135.69 142.97 45.17 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.41 1.484 . . . . 0.0 107.96 -171.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -147.53 151.07 35.7 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.023 0.929 . . . . 0.0 111.258 -170.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -139.8 141.16 34.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 169.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.91 135.49 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 -173.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -167.71 -176.75 38.61 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-O 121.984 0.769 . . . . 0.0 113.532 -178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.9 m -62.41 161.19 12.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.703 1.601 . . . . 0.0 111.605 -176.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.8 p -126.37 13.67 7.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.007 1.323 . . . . 0.0 111.966 -170.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 2.1 p90 -54.79 -50.4 68.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.772 1.629 . . . . 0.0 113.416 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -147.33 -23.3 0.39 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -172.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.64 155.35 38.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.097 0.862 . . . . 0.0 110.395 -170.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.12 -8.33 7.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.921 2.088 . . . . 0.0 110.68 175.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.4 mp -58.2 -33.93 69.83 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.975 1.31 . . . . 0.0 110.935 177.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -65.66 -33.84 76.82 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.906 0.775 . . . . 0.0 111.459 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 36.9 mt -70.42 -46.49 63.83 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.1 mmt -55.54 -40.44 71.87 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.305 173.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.76 71.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.847 0.859 . . . . 0.0 110.04 -178.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.61 -45.02 99.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 118.33 0.513 . . . . 0.0 110.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.97 -49.27 78.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.422 0.556 . . . . 0.0 110.312 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -63.52 -43.59 96.72 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.337 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 96.8 m -61.71 -45.32 94.46 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.32 -45.89 78.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.45 1.023 . . . . 0.0 110.861 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -62.41 -43.33 99.07 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.429 0.633 . . . . 0.0 110.997 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.22 -37.33 72.05 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.346 -0.846 . . . . 0.0 110.947 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -60.53 -48.54 81.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.512 0.597 . . . . 0.0 110.587 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.4 mt -50.72 -51.23 51.9 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 173.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -55.0 -42.61 72.72 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.872 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -69.42 -48.72 60.12 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 119.577 1.08 . . . . 0.0 111.777 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 11.6 ptt? -73.6 -28.72 61.97 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.459 1.027 . . . . 0.0 112.003 -174.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 21.1 tp -85.4 -35.02 21.59 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -171.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 52.26 28.88 6.01 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.307 1.443 . . . . 0.0 113.765 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -153.59 -178.25 6.89 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.235 1.814 . . . . 0.0 106.89 169.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -48.07 131.89 15.71 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.895 0.878 . . . . 0.0 109.195 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 29.9 m -79.99 38.95 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 124.733 1.213 . . . . 0.0 110.22 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -78.2 171.39 15.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.613 1.165 . . . . 0.0 111.772 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -44.88 -61.21 1.69 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.079 1.752 . . . . 0.0 112.667 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -61.93 -41.43 97.94 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.949 -0.469 . . . . 0.0 110.337 -179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.31 -31.54 67.55 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.822 -0.549 . . . . 0.0 112.098 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -77.76 -32.99 52.93 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.09 -1.006 . . . . 0.0 109.96 173.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.53 -33.88 71.95 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.736 0.698 . . . . 0.0 110.923 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -71.15 -17.83 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.27 -0.894 . . . . 0.0 113.265 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -129.98 28.44 5.06 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.453 1.024 . . . . 0.0 112.789 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.76 -48.14 2.17 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.921 1.688 . . . . 0.0 112.722 174.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.94 -37.9 89.17 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.111 0.869 . . . . 0.0 111.725 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.96 -43.51 95.84 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 176.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.25 -49.04 78.53 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.98 0.912 . . . . 0.0 110.879 173.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.08 -48.32 76.33 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.513 0.597 . . . . 0.0 109.396 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.75 -37.08 85.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.177 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.44 95.73 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.916 0.78 . . . . 0.0 110.593 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.8 t -60.38 -45.62 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 118.906 0.775 . . . . 0.0 109.09 174.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -73.49 18.2 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.064 1.346 . . . . 0.0 112.991 176.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -135.54 -25.67 1.29 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.665 1.586 . . . . 0.0 110.757 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.71 -29.09 8.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.356 1.062 . . . . 0.0 109.552 171.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.8 t -138.04 147.5 25.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 119.685 1.129 . . . . 0.0 108.638 -171.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -144.28 126.19 15.34 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 125.473 1.509 . . . . 0.0 107.366 169.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.9 32.29 59.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 119.431 -0.649 . . . . 0.0 113.657 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.76 12.52 84.43 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.264 1.032 . . . . 0.0 113.672 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.9 t -121.13 141.26 42.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 30.3 pt -55.17 140.26 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-O 121.959 0.885 . . . . 0.0 110.049 174.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -113.66 -44.22 3.22 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 126.621 1.968 . . . . 0.0 107.512 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -145.74 161.84 38.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.0 m -148.19 38.69 0.89 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.193 0.997 . . . . 0.0 110.679 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -132.95 117.44 14.94 Favored Pre-proline 0 C--O 1.235 0.335 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.65 -42.93 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.077 1.851 . . . . 0.0 113.01 -169.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.257 1.9 pp0? -69.38 -27.53 65.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.938 -1.101 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.58 -43.53 69.24 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 119.628 1.103 . . . . 0.0 109.741 175.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 11.7 t -52.46 -49.91 41.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 170.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.6 t -63.2 -39.28 84.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.697 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -57.57 -51.1 70.86 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 119.515 1.052 . . . . 0.0 109.273 175.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -62.56 -40.67 97.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.636 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.67 -43.3 96.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 120.071 1.305 . . . . 0.0 109.632 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.22 79.16 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.211 0.604 . . . . 0.0 111.512 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.31 -39.28 78.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.036 1.734 . . . . 0.0 111.974 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.139 1.376 . . . . 0.0 110.095 -176.178 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 . . . . . 0 C--O 1.235 0.334 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -63.98 -34.8 78.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.055 0.942 . . . . 0.0 110.186 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -157.13 160.6 2.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -174.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -123.06 -40.0 2.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.947 1.299 . . . . 0.0 110.088 -175.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.97 168.8 23.84 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.432 0.56 . . . . 0.0 111.179 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.4 mt -137.4 137.1 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 105.282 -2.118 . . . . 0.0 105.282 173.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -134.29 150.23 50.97 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.2 mt -137.19 120.09 20.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 169.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.7 mt -124.13 143.04 50.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -170.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.46 168.47 8.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.475 170.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -72.4 13.82 0.3 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.643 1.177 . . . . 0.0 113.794 -174.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -131.32 6.34 4.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.883 1.673 . . . . 0.0 110.327 169.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.87 5.96 59.55 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.397 1.475 . . . . 0.0 113.403 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -70.21 131.86 44.87 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 119.526 1.663 . . . . 0.0 109.918 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -60.64 118.79 7.01 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.51 -41.54 8.13 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 165.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -146.5 152.53 39.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.14 146.86 20.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 169.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.439 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -142.16 139.23 32.03 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 171.606 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -127.56 147.84 50.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 174.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -129.23 8.84 5.59 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.125 0.57 . . . . 0.0 110.571 -177.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -141.05 152.25 44.69 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.431 0.692 . . . . 0.0 111.81 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.68 -7.76 23.04 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.371 1.868 . . . . 0.0 113.962 -174.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 p -58.91 -42.73 90.33 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.149 -0.969 . . . . 0.0 112.157 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -145.16 72.26 14.6 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 119.079 0.854 . . . . 0.0 109.925 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -90.34 -1.17 5.39 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.811 2.341 . . . . 0.0 113.35 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.3 m -132.44 137.09 47.15 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.567 -169.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.4 t -46.87 -48.37 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.299 1.84 . . . . 0.0 112.683 -169.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -57.5 -48.0 80.41 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.417 0.553 . . . . 0.0 111.024 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -74.31 -33.35 63.17 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -61.34 -51.3 69.43 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.066 0.546 . . . . 0.0 110.714 174.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -61.49 -32.31 72.32 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.054 -1.029 . . . . 0.0 111.215 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -48.43 72.26 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -61.34 -38.43 86.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.406 0.683 . . . . 0.0 111.195 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.33 -44.94 93.48 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.41 1.484 . . . . 0.0 111.15 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -43.59 98.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.155 0.434 . . . . 0.0 109.84 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.29 -48.48 74.02 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.634 0.773 . . . . 0.0 110.946 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -59.27 -53.37 49.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -60.17 -44.85 94.71 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.648 0.379 . . . . 0.0 110.624 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -61.95 -47.61 84.11 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.278 0.631 . . . . 0.0 111.489 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -74.48 -48.66 25.95 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 122.787 0.435 . . . . 0.0 110.355 -170.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 p -59.18 -35.35 73.41 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.264 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -54.16 -26.76 29.65 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -77.91 -16.94 57.83 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 119.05 0.841 . . . . 0.0 112.778 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.7 p -78.33 173.24 12.53 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.364 0.984 . . . . 0.0 111.4 -174.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.22 -5.22 48.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.303 1.041 . . . . 0.0 112.125 169.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 m 77.77 143.51 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.547 2.739 . . . . 0.0 113.762 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 127.29 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 1 C-N-CA 133.338 4.655 . . . . 0.0 108.703 172.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.0 tt -154.42 157.3 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.698 1.199 . . . . 0.0 109.002 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.04 166.73 27.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.693 2.397 . . . . 0.0 107.98 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 tp -130.05 112.24 13.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 174.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -84.23 -165.52 1.18 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.04 1.336 . . . . 0.0 108.962 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.89 19.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.339 2.256 . . . . 0.0 114.369 -173.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.96 -3.0 0.47 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.559 1.552 . . . . 0.0 112.621 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.3 mt -126.32 131.98 51.72 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 118.353 1.076 . . . . 0.0 109.525 -170.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.0 m -75.68 141.61 42.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 84.5 t -137.97 117.94 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -98.2 146.23 8.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 169.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -155.66 162.72 40.54 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.989 0.359 . . . . 0.0 111.136 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -148.4 176.03 10.63 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.205 1.002 . . . . 0.0 108.636 170.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.6 p -141.26 148.6 40.09 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 m -144.7 141.87 29.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.0 mt 62.74 -78.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 126.879 2.072 . . . . 0.0 111.13 170.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -156.9 34.59 0.3 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.668 1.987 . . . . 0.0 108.931 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.5 tp -145.13 149.67 35.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.099 1.36 . . . . 0.0 109.784 -169.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -126.51 148.68 49.67 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.53 1.132 . . . . 0.0 109.231 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -137.34 140.55 41.55 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 125.378 1.471 . . . . 0.0 107.968 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -145.13 149.03 34.28 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 123.948 0.899 . . . . 0.0 110.501 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 96.5 t -136.32 136.54 48.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 169.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -127.44 137.77 56.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 -170.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -158.24 -177.39 31.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-O 121.742 0.635 . . . . 0.0 112.11 -176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 m -58.76 158.12 8.53 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.136 1.374 . . . . 0.0 112.188 -174.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 p -74.46 38.5 0.12 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.458 1.903 . . . . 0.0 111.058 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -69.05 167.93 14.94 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.978 1.311 . . . . 0.0 111.029 -171.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.69 -10.25 50.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.455 1.102 . . . . 0.0 113.375 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -148.01 171.19 16.22 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.903 1.281 . . . . 0.0 108.889 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.53 3.63 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.233 2.213 . . . . 0.0 110.76 -170.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.83 -31.68 72.78 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.472 1.109 . . . . 0.0 110.868 -173.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -33.44 75.82 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.871 0.759 . . . . 0.0 111.332 173.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.2 mt -71.19 -44.7 64.92 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.2 mmt -56.03 -41.0 74.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.282 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.39 -47.04 80.74 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.472 0.709 . . . . 0.0 110.3 -178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.1 t -62.01 -45.66 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-O 118.696 -0.668 . . . . 0.0 109.943 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 58.8 tp -61.21 -47.73 84.76 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.874 0.761 . . . . 0.0 110.331 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -64.56 -43.63 93.31 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.32 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 45.8 t -60.62 -50.61 72.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.268 0.627 . . . . 0.0 109.685 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.0 tp -61.97 -46.48 89.1 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.319 0.509 . . . . 0.0 110.992 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -64.67 -42.39 95.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.312 0.506 . . . . 0.0 111.046 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.73 -37.73 82.58 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 121.435 -0.791 . . . . 0.0 110.644 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.2 m -61.5 -46.73 88.77 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.664 0.785 . . . . 0.0 110.84 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.9 mt -54.72 -47.98 73.08 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.0 m -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.859 0.464 . . . . 0.0 111.879 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -73.12 -55.22 6.77 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.824 1.193 . . . . 0.0 109.69 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 67.0 mtm -66.03 -41.94 90.24 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.276 0.36 . . . . 0.0 111.751 -169.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.95 -35.86 77.26 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 118.041 0.382 . . . . 0.0 110.601 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.94 27.87 6.0 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.849 1.259 . . . . 0.0 112.455 -174.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -155.61 -175.34 5.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 126.739 2.016 . . . . 0.0 107.99 174.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.29 125.88 22.61 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.978 0.911 . . . . 0.0 108.789 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.3 m -77.95 46.73 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 125.371 1.468 . . . . 0.0 110.857 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.33 167.79 20.96 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.274 -0.891 . . . . 0.0 111.423 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -44.8 -54.17 6.64 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.104 1.762 . . . . 0.0 112.355 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -40.27 88.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.143 -0.348 . . . . 0.0 110.525 -176.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.5 -34.93 79.36 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.973 -0.455 . . . . 0.0 111.428 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.0 mp -67.87 -43.57 79.1 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 119.191 0.905 . . . . 0.0 110.46 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 69.7 tp -56.02 -37.26 68.95 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.28 0.491 . . . . 0.0 110.848 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -70.13 -18.81 63.24 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.279 1.032 . . . . 0.0 113.169 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -129.14 23.2 5.63 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.565 1.075 . . . . 0.0 111.442 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.65 -47.59 20.13 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.219 1.408 . . . . 0.0 111.832 -178.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -63.92 -39.73 94.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.941 0.791 . . . . 0.0 111.515 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.78 -43.6 95.97 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 tp -58.81 -50.44 73.95 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.287 1.035 . . . . 0.0 110.653 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -54.43 -49.03 70.94 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.481 0.712 . . . . 0.0 109.719 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.47 -33.87 76.01 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.601 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.94 80.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 118.859 0.754 . . . . 0.0 110.014 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 72.9 t -60.49 -41.04 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 118.658 0.663 . . . . 0.0 109.95 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.58 -24.83 67.96 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.402 0.681 . . . . 0.0 112.534 177.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -87.05 -34.73 19.08 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.576 -0.702 . . . . 0.0 110.683 177.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.86 -39.22 45.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.765 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 23.9 t -137.66 148.18 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 120.274 1.397 . . . . 0.0 111.851 -169.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -150.66 133.02 15.52 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.847 1.659 . . . . 0.0 108.033 169.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.66 24.99 54.84 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-O 119.487 -0.618 . . . . 0.0 114.632 173.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.07 18.33 69.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.379 1.09 . . . . 0.0 112.856 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.92 141.67 44.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.9 pt -70.55 154.96 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 119.684 -0.806 . . . . 0.0 109.859 176.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.6 mt -118.9 -19.28 8.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.029 1.331 . . . . 0.0 110.021 169.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -155.37 160.83 41.01 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 108.623 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -143.6 -5.98 0.81 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.558 1.143 . . . . 0.0 112.262 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.07 118.63 70.29 Favored Pre-proline 0 C--O 1.236 0.375 0 CA-C-N 119.735 1.152 . . . . 0.0 109.359 170.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -67.55 -30.94 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.902 1.735 . . . . 0.0 112.273 -174.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -64.64 -47.64 77.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -62.9 -38.69 91.94 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 118.392 0.542 . . . . 0.0 110.215 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.24 -58.49 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 30.1 m -67.0 -32.84 59.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.653 -173.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -61.13 -52.22 65.8 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.404 1.002 . . . . 0.0 109.987 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 80.0 mtt180 -61.52 -44.46 97.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 118.543 0.61 . . . . 0.0 110.091 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 15.2 t -58.45 -47.99 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.32 0.648 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.67 -29.92 56.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 122.681 0.392 . . . . 0.0 111.341 -171.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.27 -34.29 65.71 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.37 0.668 . . . . 0.0 111.108 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.1 mtm-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-N 118.375 0.534 . . . . 0.0 110.167 174.912 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 . . . . . 0 C--O 1.234 0.272 0 CA-C-O 119.752 -0.166 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.2 p -70.75 -32.09 69.13 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.408 0.683 . . . . 0.0 110.287 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.2 m -139.3 167.34 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.315 1.046 . . . . 0.0 109.173 -179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -131.25 -27.94 1.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 117.369 -1.301 . . . . 0.0 110.591 173.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.77 165.66 29.98 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 120.179 1.354 . . . . 0.0 112.123 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.9 mt -135.03 136.85 51.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 169.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -133.57 149.75 51.64 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.5 mt -138.32 118.86 15.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 104.276 -2.49 . . . . 0.0 104.276 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 55.9 mt -122.71 144.92 48.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 -175.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.5 169.11 6.42 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.086 0.47 . . . . 0.0 110.519 169.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.78 -11.97 1.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.0 3.49 13.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.049 1.34 . . . . 0.0 110.743 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.16 6.41 55.69 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.09 1.328 . . . . 0.0 112.85 171.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.79 128.08 35.38 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 119.564 1.682 . . . . 0.0 109.869 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -60.9 120.83 10.93 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -101.96 -41.73 6.36 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 166.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -145.81 151.99 38.8 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.53 144.53 15.47 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 168.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -148.2 147.85 29.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -132.7 145.61 51.18 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -131.6 1.15 4.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.295 1.038 . . . . 0.0 111.493 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -134.05 162.62 31.59 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.925 0.89 . . . . 0.0 108.914 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -71.78 4.2 3.48 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.495 1.918 . . . . 0.0 113.611 -169.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -62.24 -48.5 79.66 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.445 1.098 . . . . 0.0 111.275 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -143.94 74.99 16.1 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 124.162 0.985 . . . . 0.0 108.989 -176.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.23 -1.88 6.96 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.582 2.188 . . . . 0.0 113.568 -172.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.6 m -134.22 139.21 45.63 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.098 0.959 . . . . 0.0 109.238 -169.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -43.73 -52.85 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.431 1.893 . . . . 0.0 112.98 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.99 -42.11 98.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.464 0.575 . . . . 0.0 111.28 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.27 -34.62 73.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -64.85 -49.81 69.08 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.289 0.635 . . . . 0.0 110.292 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.56 -35.69 70.66 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.449 -0.782 . . . . 0.0 111.033 177.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.44 -43.58 73.02 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.961 0.505 . . . . 0.0 109.932 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -62.43 -37.88 87.56 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.071 -0.393 . . . . 0.0 110.759 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -64.99 -43.12 93.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.72 1.608 . . . . 0.0 111.005 178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -59.27 -46.58 88.13 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.267 0.485 . . . . 0.0 109.86 172.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -46.67 83.58 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.731 0.812 . . . . 0.0 111.1 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.3 mm -57.43 -53.52 42.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 124.417 1.087 . . . . 0.0 108.344 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.46 -48.4 81.94 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.651 0.38 . . . . 0.0 110.366 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -56.95 -43.67 81.78 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.031 0.932 . . . . 0.0 111.911 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -76.36 -48.9 18.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.053 0.541 . . . . 0.0 109.937 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.9 p -65.96 -30.23 70.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.672 -0.642 . . . . 0.0 112.048 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -56.64 -24.42 48.09 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.486 -0.758 . . . . 0.0 111.782 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -110.64 21.41 16.6 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.31 1.444 . . . . 0.0 110.485 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.7 m -128.87 153.51 47.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.392 1.077 . . . . 0.0 109.322 -173.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -83.21 93.79 7.74 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.182 0.993 . . . . 0.0 109.048 176.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.435 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 2.4 m -45.4 140.85 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.468 1.907 . . . . 0.0 115.96 -171.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 144.73 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 1 C-N-CA 133.223 4.609 . . . . 0.0 107.231 170.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -151.92 156.93 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.833 1.253 . . . . 0.0 109.041 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 171.75 17.61 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.398 2.279 . . . . 0.0 107.559 173.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 tt -142.23 117.7 10.27 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.86 -1.904 . . . . 0.0 105.86 169.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 mp -111.94 103.75 11.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -169.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 61.34 -2.25 0.24 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.196 2.198 . . . . 0.0 115.324 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.8 -27.91 1.3 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 126.021 1.772 . . . . 0.0 111.33 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -85.77 132.64 34.09 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 118.314 1.057 . . . . 0.0 108.873 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 m -82.82 140.67 32.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 175.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 89.7 t -139.21 138.24 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -173.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.9 m -123.91 149.77 28.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.435 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 28.6 p90 -157.32 165.99 34.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.503 0.668 . . . . 0.0 111.876 -175.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -151.16 159.6 44.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 127.305 2.242 . . . . 0.0 106.641 -169.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -138.42 144.45 40.18 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.7 m -138.74 119.65 14.34 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.039 1.336 . . . . 0.0 108.432 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.3 mp 62.58 -76.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 126.781 2.032 . . . . 0.0 113.061 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -143.39 21.84 1.86 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.607 1.563 . . . . 0.0 109.943 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.89 149.99 52.29 Favored 'General case' 0 N--CA 1.458 -0.075 0 C-N-CA 125.616 1.566 . . . . 0.0 109.387 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -130.4 142.18 50.52 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.983 1.313 . . . . 0.0 108.183 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -124.08 142.78 50.9 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.349 1.459 . . . . 0.0 107.087 -177.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -142.98 147.82 35.8 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.76 0.824 . . . . 0.0 109.251 -176.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.91 138.41 50.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.95 136.96 57.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 -172.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.07 -179.5 27.75 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-O 122.133 0.852 . . . . 0.0 112.192 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.4 m -59.62 165.89 2.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.696 1.599 . . . . 0.0 112.192 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -67.66 6.6 0.62 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.919 1.688 . . . . 0.0 114.541 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.29 122.94 17.85 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -175.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.16 -18.69 63.74 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.081 1.352 . . . . 0.0 114.555 -169.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -66.2 -32.43 73.86 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.705 -170.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.282 2.0 pp20? 48.39 -10.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.23 3.012 . . . . 0.0 118.463 -176.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 33.2 mt -63.8 -32.22 73.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 120.441 -1.412 . . . . 0.0 111.18 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -33.96 77.08 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.185 0.902 . . . . 0.0 111.532 174.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.3 mt -68.65 -47.35 66.77 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 19.2 mmt -55.4 -41.59 72.92 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.458 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.1 -51.69 66.92 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.282 0.633 . . . . 0.0 109.503 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.45 -44.81 99.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.223 0.465 . . . . 0.0 110.34 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.3 tp -61.31 -49.28 77.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.329 0.513 . . . . 0.0 110.471 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -65.21 -40.59 94.36 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.412 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.6 m -61.68 -46.94 87.56 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.442 0.565 . . . . 0.0 110.091 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.26 -51.35 66.52 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 118.55 0.613 . . . . 0.0 110.033 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -58.07 -47.18 83.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.215 0.606 . . . . 0.0 111.427 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -79.9 -29.21 39.83 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.474 -0.766 . . . . 0.0 111.894 -173.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.2 t -68.62 -43.55 76.11 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 119.249 0.931 . . . . 0.0 110.085 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 37.2 mt -53.33 -49.81 66.3 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 169.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.0 m -60.13 -32.01 70.61 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.22 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 35.3 mm-40 -65.82 -62.26 1.6 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 120.013 1.278 . . . . 0.0 109.513 174.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -72.65 -36.55 68.01 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -169.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 20.1 tp -73.88 -30.94 62.91 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.847 0.294 . . . . 0.0 111.352 -172.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 58.27 28.14 16.22 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.171 1.388 . . . . 0.0 113.08 172.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -150.15 176.56 10.73 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.935 2.094 . . . . 0.0 106.705 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -55.01 129.74 39.05 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.385 0.674 . . . . 0.0 109.719 169.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 24.5 m -81.5 48.06 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 109.727 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.11 176.74 4.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.124 -0.985 . . . . 0.0 111.737 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -46.84 -57.87 4.48 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.364 1.866 . . . . 0.0 112.836 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -64.8 -37.42 87.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.368 0.531 . . . . 0.0 110.674 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.26 -32.61 72.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.409 0.284 . . . . 0.0 110.879 -177.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.5 mp -75.02 -38.54 61.49 Favored 'General case' 0 CA--C 1.514 -0.404 0 O-C-N 120.594 -1.316 . . . . 0.0 111.821 172.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.7 tp -55.96 -39.28 71.55 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.48 0.582 . . . . 0.0 110.62 174.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -75.87 -10.57 59.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.33 24.93 4.16 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.726 1.148 . . . . 0.0 113.246 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -43.97 -44.9 7.51 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.042 1.337 . . . . 0.0 112.233 177.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.73 -40.73 95.82 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.042 0.837 . . . . 0.0 111.776 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.48 -42.95 98.82 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 176.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -55.75 -49.02 74.23 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.112 0.965 . . . . 0.0 110.449 172.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -58.03 -45.84 86.28 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.622 0.646 . . . . 0.0 109.851 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.09 -37.45 85.81 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 119.118 -0.468 . . . . 0.0 111.356 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.38 90.42 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 119.016 0.825 . . . . 0.0 110.096 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.97 -46.34 87.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.721 0.691 . . . . 0.0 109.746 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.7 -30.72 68.99 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.959 0.904 . . . . 0.0 112.661 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -85.79 -29.8 23.52 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.746 -0.596 . . . . 0.0 111.323 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 68.5 mt -78.99 -41.62 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.307 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -145.96 153.25 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 119.918 1.236 . . . . 0.0 110.836 -170.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -155.84 141.44 17.85 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.885 1.274 . . . . 0.0 108.799 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.61 25.08 54.85 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.423 -0.654 . . . . 0.0 114.125 173.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 86.35 8.81 77.24 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 118.077 0.939 . . . . 0.0 113.203 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.3 t -127.44 142.25 44.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 119.305 1.552 . . . . 0.0 106.953 -177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -62.37 155.93 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.598 0.713 . . . . 0.0 110.33 171.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.6 mt -122.69 -23.41 5.12 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.919 1.688 . . . . 0.0 109.834 171.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -154.55 161.31 41.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.935 0.789 . . . . 0.0 109.315 173.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 9.1 p -144.74 34.17 1.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.406 1.482 . . . . 0.0 110.448 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.68 120.84 6.7 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.908 0.883 . . . . 0.0 109.924 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -64.73 -33.36 54.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.188 2.592 . . . . 0.0 114.608 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.292 2.5 pp0? -84.42 -27.38 27.63 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.09 0.859 . . . . 0.0 111.523 -176.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -68.74 -40.68 79.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.018 1.281 . . . . 0.0 108.755 168.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.3 t -55.09 -53.22 36.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 118.223 -0.894 . . . . 0.0 108.78 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.28 -37.12 79.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 119.966 1.257 . . . . 0.0 111.132 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 -48.44 81.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.584 0.629 . . . . 0.0 109.515 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -68.27 -34.74 76.73 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.853 0.751 . . . . 0.0 111.636 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 48.7 t -61.98 -43.81 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 119.182 0.901 . . . . 0.0 109.448 174.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.97 -32.12 73.14 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.506 0.594 . . . . 0.0 111.426 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 37.4 tp -73.16 -24.83 60.62 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.86 1.664 . . . . 0.0 112.293 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 . . . . . 0 C--O 1.25 1.123 0 CA-C-N 118.597 0.635 . . . . 0.0 110.257 172.728 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.235 0.334 0 CA-C-O 119.613 -0.232 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 32.4 p -71.34 -32.0 68.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 171.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.5 140.8 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -100.52 -25.25 14.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 117.513 -1.232 . . . . 0.0 109.787 171.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.1 167.77 23.72 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.768 1.167 . . . . 0.0 111.89 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mt -138.96 139.29 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mt -138.25 154.4 49.07 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.3 mt -138.05 120.46 18.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 103.814 -2.662 . . . . 0.0 103.814 168.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.9 mt -125.99 145.46 50.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -169.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 170.73 3.39 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.678 0.791 . . . . 0.0 110.905 170.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -63.48 2.33 0.44 Allowed 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -131.32 9.66 4.78 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.688 1.595 . . . . 0.0 110.738 175.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.09 19.97 48.22 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 118.645 -1.086 . . . . 0.0 113.095 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -78.34 132.68 37.52 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.778 1.789 . . . . 0.0 109.697 171.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 ttm180 -61.53 116.83 5.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.354 0.662 . . . . 0.0 109.673 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mt -85.53 -43.27 13.67 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 157.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -148.87 148.48 29.91 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.953 1.301 . . . . 0.0 108.188 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.03 146.7 14.41 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.414 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 3.3 mmpt? -141.28 149.14 40.88 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.65 1.58 . . . . 0.0 107.733 172.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -139.68 144.55 37.64 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.614 1.566 . . . . 0.0 107.596 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -135.0 -1.96 2.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.316 1.047 . . . . 0.0 112.041 -170.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -134.4 160.04 39.2 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.47 0.708 . . . . 0.0 109.447 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.95 3.89 4.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.846 2.059 . . . . 0.0 112.871 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -61.03 -47.62 85.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.663 1.185 . . . . 0.0 110.819 177.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -144.07 75.08 15.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.312 1.045 . . . . 0.0 108.888 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -90.03 -1.01 5.61 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.726 2.284 . . . . 0.0 113.687 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 m -134.34 137.87 44.49 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.017 0.927 . . . . 0.0 109.463 -169.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.7 t -46.09 -49.84 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.066 1.746 . . . . 0.0 112.866 -169.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.18 -47.68 82.67 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.559 0.618 . . . . 0.0 111.019 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -73.92 -32.47 63.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.148 0.431 . . . . 0.0 110.36 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -61.79 -51.15 69.45 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.089 0.555 . . . . 0.0 110.594 174.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.18 -35.55 75.62 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.354 -0.841 . . . . 0.0 110.85 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.53 78.59 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.57 -38.54 87.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 110.916 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.38 -42.75 99.66 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.465 1.506 . . . . 0.0 111.08 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -65.49 -41.97 92.66 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.583 0.629 . . . . 0.0 109.985 174.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.418 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -55.89 -46.16 78.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.052 0.541 . . . . 0.0 111.11 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.9 mm -60.56 -52.4 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -60.44 -46.01 91.6 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.742 0.701 . . . . 0.0 110.521 -177.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -55.66 -47.39 76.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.869 0.867 . . . . 0.0 111.628 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -67.69 -52.12 41.59 Favored 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 123.28 0.632 . . . . 0.0 110.227 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 36.2 p -70.7 -33.43 70.87 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.845 -0.534 . . . . 0.0 112.207 -169.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -64.71 -12.86 51.26 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.139 -0.976 . . . . 0.0 111.961 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -111.03 13.81 21.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.612 1.965 . . . . 0.0 111.361 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.8 m -120.33 159.48 24.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.556 1.142 . . . . 0.0 109.111 -176.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.24 31.84 0.45 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.675 1.59 . . . . 0.0 112.824 -169.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m 68.24 178.03 0.25 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.392 1.877 . . . . 0.0 113.603 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 11.1 pt-20 56.25 -44.05 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.415 3.886 . . . . 0.0 117.138 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -150.44 154.29 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 120.305 1.412 . . . . 0.0 109.259 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.15 163.8 36.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.839 2.056 . . . . 0.0 108.798 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.28 120.87 34.38 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.418 HD13 HD22 ' A' ' 47' ' ' ASN . 3.2 mm? -111.18 71.1 0.73 Allowed 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 126.167 1.787 . . . . 0.0 107.632 -172.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 62.84 7.95 2.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.533 1.533 . . . . 0.0 113.815 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 145.95 -33.91 1.47 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.327 1.918 . . . . 0.0 110.42 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.22 156.78 38.77 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.615 0.766 . . . . 0.0 109.141 170.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -117.06 138.77 51.39 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 77.8 t -136.33 139.31 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 -169.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.1 t -132.9 131.22 59.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -156.81 164.61 37.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -168.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 pttp -154.68 179.04 9.44 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.496 0.719 . . . . 0.0 109.232 169.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 p -138.34 146.06 41.89 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.4 m -147.9 146.03 28.88 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.461 1.104 . . . . 0.0 109.592 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 52.52 -83.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 127.03 2.132 . . . . 0.0 110.882 -172.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -152.81 29.43 0.52 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.82 2.048 . . . . 0.0 109.226 -176.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.2 tp -136.7 153.42 50.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.436 1.494 . . . . 0.0 110.27 -169.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -122.91 149.29 44.43 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.324 1.05 . . . . 0.0 109.125 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -136.89 141.56 42.75 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.587 1.555 . . . . 0.0 107.873 -172.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -145.18 150.24 36.39 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.074 0.95 . . . . 0.0 112.004 -169.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.4 t -137.19 138.74 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.51 137.91 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.7 -179.7 36.54 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.505 1.058 . . . . 0.0 113.006 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -172.94 0.67 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.595 -1.803 . . . . 0.0 109.658 175.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.8 t -142.35 161.34 38.27 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -155.23 -50.1 0.09 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.346 1.059 . . . . 0.0 109.285 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -150.4 -18.32 0.24 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.676 0.79 . . . . 0.0 111.828 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.414 ' C ' HD21 ' A' ' 86' ' ' ASN . 0.1 OUTLIER -155.48 171.74 19.41 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 123.823 0.849 . . . . 0.0 111.085 -175.208 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -1.4 14.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.729 2.412 . . . . 0.0 110.518 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.35 -32.69 68.77 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.733 1.213 . . . . 0.0 111.697 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -34.34 76.39 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.722 0.692 . . . . 0.0 111.274 177.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -69.45 -43.45 73.25 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 46.0 mmm -59.72 -40.11 86.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.348 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.84 76.9 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.766 0.827 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.26 -43.18 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 118.583 -0.722 . . . . 0.0 110.185 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 tp -60.85 -48.51 81.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.112 0.869 . . . . 0.0 110.477 178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -62.7 -46.4 88.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 119.341 -0.362 . . . . 0.0 110.317 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 89.7 m -60.61 -46.73 89.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.911 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.2 tp -61.01 -52.36 65.33 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 119.187 0.903 . . . . 0.0 111.024 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -66.01 -40.62 91.26 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.065 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.12 -31.58 66.16 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.497 -0.752 . . . . 0.0 111.311 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 71.0 m -62.58 -49.84 73.66 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.614 0.765 . . . . 0.0 110.312 172.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 74.8 mt -53.07 -46.64 68.66 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.3 m -58.68 -41.12 85.46 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 118.552 -0.737 . . . . 0.0 112.104 178.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -67.39 -42.04 83.99 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 119.828 1.195 . . . . 0.0 111.419 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.0 ptp -76.75 -36.22 57.24 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.14 0.882 . . . . 0.0 111.622 -175.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.85 -33.95 24.74 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 118.663 0.665 . . . . 0.0 112.015 -173.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 50.15 29.9 3.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.591 1.156 . . . . 0.0 112.822 -176.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -154.84 -178.07 6.96 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 126.316 1.847 . . . . 0.0 107.486 169.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -53.78 121.17 7.35 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.511 0.672 . . . . 0.0 111.104 176.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.1 m -79.32 50.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.373 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.98 175.99 6.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.041 0.936 . . . . 0.0 111.974 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -46.88 -56.56 6.12 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.369 1.468 . . . . 0.0 112.279 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -62.37 -44.47 96.4 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.137 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.69 83.76 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.501 0.591 . . . . 0.0 110.329 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.25 -38.04 75.05 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 118.498 -0.763 . . . . 0.0 112.081 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.24 -38.38 76.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.903 0.774 . . . . 0.0 110.831 176.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -72.04 -14.71 61.94 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -125.06 21.34 8.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.506 1.048 . . . . 0.0 111.923 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -48.37 -49.51 34.34 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.444 1.098 . . . . 0.0 112.215 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.49 -36.49 81.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.617 0.644 . . . . 0.0 111.361 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.15 -43.88 98.5 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 173.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -61.2 -49.34 77.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.68 1.192 . . . . 0.0 110.845 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -53.17 -49.96 65.59 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.131 0.878 . . . . 0.0 110.068 175.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 65.0 mt -65.89 -41.38 91.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 119.179 -0.439 . . . . 0.0 111.037 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.52 93.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.598 0.636 . . . . 0.0 110.294 178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.9 t -57.81 -44.39 86.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 118.288 0.495 . . . . 0.0 109.702 175.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -66.77 -5.75 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.606 1.162 . . . . 0.0 113.63 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -112.15 -28.81 7.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.017 1.327 . . . . 0.0 110.555 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 82.5 mt -66.97 -43.17 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.453 1.024 . . . . 0.0 108.723 171.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.45 155.19 28.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 124.303 1.041 . . . . 0.0 109.856 -174.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -149.67 131.44 15.06 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.221 1.408 . . . . 0.0 107.814 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.22 30.78 55.65 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 119.28 -0.733 . . . . 0.0 113.201 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.59 12.56 84.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 118.268 1.034 . . . . 0.0 113.846 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 t -123.72 141.41 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.155 1.478 . . . . 0.0 107.038 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.0 pt -55.71 138.7 15.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.456 0.646 . . . . 0.0 110.174 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -122.1 -38.8 2.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.126 1.77 . . . . 0.0 108.564 -172.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.55 153.39 43.52 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 169.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.3 m -133.37 28.21 4.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.216 1.407 . . . . 0.0 110.305 -169.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -139.22 125.72 12.52 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.229 1.012 . . . . 0.0 108.71 176.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.23 -38.39 3.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.843 2.362 . . . . 0.0 113.71 -171.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -28.11 57.58 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.032 -1.043 . . . . 0.0 110.433 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 68.0 mm-40 -61.8 -50.41 72.41 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.326 0.966 . . . . 0.0 109.748 169.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 12.3 t -51.98 -57.14 4.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 124.103 0.961 . . . . 0.0 109.02 177.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.5 t -63.56 -43.68 98.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.756 -173.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -57.36 -52.57 64.83 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 118.44 0.564 . . . . 0.0 109.643 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -57.32 -47.14 82.31 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.113 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 33.1 m -75.9 -28.47 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-N 120.385 1.448 . . . . 0.0 112.031 -172.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.96 -35.31 62.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.526 0.603 . . . . 0.0 110.981 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 52.6 tp -67.9 -41.2 83.07 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.961 1.704 . . . . 0.0 111.27 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 124.478 1.111 . . . . 0.0 110.03 -179.373 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.235 0.338 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.3 p -73.19 -23.14 60.37 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.886 -176.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.3 m -138.87 163.04 27.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 C-N-CA 123.906 0.882 . . . . 0.0 108.754 173.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -123.04 -28.12 4.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 117.247 -1.358 . . . . 0.0 110.166 171.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.82 165.31 30.47 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 120.094 1.315 . . . . 0.0 112.144 175.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.3 mt -133.23 133.8 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 170.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -131.19 146.46 52.34 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.5 mt -142.69 114.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 103.419 -2.808 . . . . 0.0 103.419 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.2 mt -124.89 148.1 48.48 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.419 0.688 . . . . 0.0 109.318 -169.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.79 170.55 13.38 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.915 169.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -60.26 -17.15 40.06 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -99.56 -14.31 19.08 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.647 1.112 . . . . 0.0 110.939 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.58 12.22 13.48 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 125.674 1.606 . . . . 0.0 112.239 175.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.93 132.04 47.14 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.158 1.479 . . . . 0.0 109.751 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -68.23 82.59 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.716 1.607 . . . . 0.0 109.853 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.42 -47.95 77.22 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -148.99 150.68 33.25 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.682 0.793 . . . . 0.0 109.116 171.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.29 145.74 19.48 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 169.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -147.95 148.07 30.37 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -134.21 144.65 48.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -130.04 0.44 4.73 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.169 0.988 . . . . 0.0 111.514 -172.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -133.8 161.78 33.79 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.671 0.788 . . . . 0.0 109.244 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -72.68 4.9 3.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.476 1.91 . . . . 0.0 113.071 -169.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.8 p -62.67 -48.77 77.88 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.713 1.205 . . . . 0.0 110.954 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -143.24 73.36 17.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.311 1.045 . . . . 0.0 109.026 -176.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -88.28 -1.47 6.91 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.727 2.285 . . . . 0.0 113.582 -171.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.5 m -133.29 138.13 46.29 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.213 1.005 . . . . 0.0 109.012 -170.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -45.4 -50.59 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 126.133 1.773 . . . . 0.0 112.999 -169.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -60.28 -43.96 95.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.724 0.693 . . . . 0.0 111.07 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -71.53 -33.5 69.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.049 0.386 . . . . 0.0 110.104 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -62.32 -49.6 74.98 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.073 0.549 . . . . 0.0 110.047 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.37 -37.78 75.94 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.309 -0.869 . . . . 0.0 111.137 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.38 77.65 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.978 0.511 . . . . 0.0 109.681 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -61.94 -37.53 85.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.117 0.567 . . . . 0.0 110.914 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -63.74 -42.81 97.8 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.455 1.502 . . . . 0.0 111.059 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -62.61 -43.42 98.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.316 0.962 . . . . 0.0 109.812 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.71 -48.76 77.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.979 0.512 . . . . 0.0 110.983 175.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.83 -51.99 63.46 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 C-N-CA 124.149 0.98 . . . . 0.0 108.969 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -59.34 -47.16 86.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.185 0.594 . . . . 0.0 110.107 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -60.21 -48.17 82.86 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.541 0.736 . . . . 0.0 111.361 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -70.13 -43.07 71.72 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.423 0.689 . . . . 0.0 110.827 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.8 p -67.5 -34.28 76.82 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.562 -0.712 . . . . 0.0 111.087 -176.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -65.51 -7.03 12.39 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.1 0.864 . . . . 0.0 112.853 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -119.11 25.02 10.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.689 1.996 . . . . 0.0 109.432 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 84.2 m -129.51 153.07 48.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.516 1.927 . . . . 0.0 107.211 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.99 -45.66 92.66 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.514 -173.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.5 m 145.81 -175.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 1 C-N-CA 132.458 4.303 . . . . 0.0 108.39 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.4 pt-20 57.76 -49.21 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 130.981 3.712 . . . . 0.0 116.413 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.1 tt -152.96 153.67 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 120.798 1.636 . . . . 0.0 110.484 -173.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.5 159.93 42.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.227 1.411 . . . . 0.0 110.232 171.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -113.56 99.07 7.47 Favored 'General case' 0 CA--C 1.52 -0.204 1 N-CA-C 100.065 -4.05 . . . . 0.0 100.065 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.6 tp -65.32 -66.36 0.56 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.033 -168.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -146.22 6.97 1.01 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.332 1.853 . . . . 0.0 110.263 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.27 -41.46 1.25 Allowed Glycine 0 CA--C 1.526 0.744 0 C-N-CA 126.361 1.934 . . . . 0.0 108.283 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.9 mt -66.61 139.68 57.9 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 169.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.3 m -98.98 142.81 29.99 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.44 142.15 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 m -111.42 147.63 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 169.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -152.79 157.59 41.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.088 0.47 . . . . 0.0 110.73 174.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.449 ' HE2' ' CE2' ' A' ' 98' ' ' PHE . 18.1 ptmt -144.49 171.37 14.45 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 169.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 m -140.44 137.91 34.3 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -145.12 140.56 28.1 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.225 0.61 . . . . 0.0 109.864 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.9 mp 50.36 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 127.358 2.263 . . . . 0.0 111.374 -169.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -142.61 16.27 1.99 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.471 1.908 . . . . 0.0 110.492 -176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.1 145.99 44.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.846 2.058 . . . . 0.0 108.097 -169.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.24 138.08 53.02 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -134.13 139.15 45.71 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.61 1.164 . . . . 0.0 108.039 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -144.78 147.11 32.53 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.862 0.865 . . . . 0.0 110.059 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 70.9 t -137.82 131.08 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.0 139.46 48.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 -172.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -157.39 179.23 33.3 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-O 122.58 1.1 . . . . 0.0 113.074 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -62.4 156.04 23.66 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.266 1.826 . . . . 0.0 112.73 -171.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -71.81 33.35 0.06 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 127.575 2.35 . . . . 0.0 112.325 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -70.96 179.0 2.9 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.846 1.658 . . . . 0.0 111.285 -172.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -63.96 -12.94 42.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.085 1.754 . . . . 0.0 113.333 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -146.04 163.69 34.46 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.137 0.975 . . . . 0.0 110.172 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -7.15 7.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.833 2.453 . . . . 0.0 110.298 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -56.99 -36.34 70.25 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.79 1.636 . . . . 0.0 110.368 177.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -64.78 -34.9 79.43 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.1 0.56 . . . . 0.0 112.161 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -47.71 69.03 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -42.68 67.69 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.201 1.0 . . . . 0.0 110.052 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.71 65.35 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.006 1.322 . . . . 0.0 110.212 -177.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.97 -44.04 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.136 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 65.9 tp -61.2 -48.04 83.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 118.506 0.593 . . . . 0.0 110.341 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.56 -44.45 96.31 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 119.126 -0.464 . . . . 0.0 110.406 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.6 m -61.47 -45.9 92.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.275 0.489 . . . . 0.0 110.473 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.71 -49.3 68.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.478 0.581 . . . . 0.0 109.968 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.449 ' CE2' ' HE2' ' A' ' 70' ' ' LYS . 51.3 t80 -62.23 -42.22 99.12 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.899 0.381 . . . . 0.0 111.114 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -69.62 -37.27 76.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.533 -0.73 . . . . 0.0 110.647 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.5 m -62.97 -44.79 95.07 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.731 0.696 . . . . 0.0 111.221 175.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.8 mt -52.55 -51.46 59.58 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.6 m -58.44 -40.41 82.5 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.602 0.564 . . . . 0.0 111.097 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -66.74 -44.34 81.76 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.59 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -81.54 -30.64 33.05 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.782 1.174 . . . . 0.0 112.179 -177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -75.78 -44.66 40.38 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 119.154 0.888 . . . . 0.0 111.907 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 50.85 34.65 10.66 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.23 1.012 . . . . 0.0 111.973 -170.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -152.8 -176.92 5.95 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.784 1.633 . . . . 0.0 108.15 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -50.29 126.33 14.64 Favored 'General case' 0 CA--C 1.522 -0.112 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 35.1 m -76.04 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.399 1.48 . . . . 0.0 110.002 169.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.04 174.78 9.47 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.425 1.09 . . . . 0.0 110.805 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -52.08 -48.62 64.59 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.614 1.166 . . . . 0.0 112.304 -170.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 41.7 tpt85 -65.88 -35.92 81.98 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.907 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.0 -39.23 66.2 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.733 0.697 . . . . 0.0 111.107 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.03 -45.97 86.09 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 121.563 -0.711 . . . . 0.0 109.351 171.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 67.3 tp -61.34 -38.38 86.71 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.202 0.601 . . . . 0.0 111.793 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -65.29 -28.11 69.1 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.94 21.85 9.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.803 0.729 . . . . 0.0 112.531 -169.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.56 -50.77 2.22 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 125.564 1.546 . . . . 0.0 112.691 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -65.58 -39.24 91.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.076 0.853 . . . . 0.0 111.541 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.74 -43.17 99.35 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.11 -49.42 77.94 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.123 0.969 . . . . 0.0 110.605 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.58 -46.87 80.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.758 0.708 . . . . 0.0 109.708 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -65.75 -40.05 91.69 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.084 -0.484 . . . . 0.0 110.749 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.98 96.6 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.981 0.81 . . . . 0.0 110.125 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.77 -46.11 90.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 118.923 -0.56 . . . . 0.0 109.727 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -63.42 -25.47 68.29 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -84.85 -40.03 17.6 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.626 -0.671 . . . . 0.0 111.228 173.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.37 -42.54 87.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 119.136 0.88 . . . . 0.0 109.799 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -139.05 150.07 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.072 0 CA-C-N 119.245 0.929 . . . . 0.0 110.592 -174.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -149.97 132.96 16.17 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 125.059 1.344 . . . . 0.0 108.365 177.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.74 25.98 56.77 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.506 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 79.56 14.27 81.47 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.299 1.049 . . . . 0.0 113.255 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 20.2 t -126.73 141.43 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 119.257 1.529 . . . . 0.0 107.388 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -57.31 138.67 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.658 0.742 . . . . 0.0 109.852 172.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -125.3 -36.63 2.47 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.321 1.849 . . . . 0.0 108.21 -172.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -140.19 156.63 46.43 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 169.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.3 m -151.21 39.34 0.67 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.302 -0.874 . . . . 0.0 110.936 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -140.71 120.19 8.55 Favored Pre-proline 0 C--O 1.234 0.284 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 -29.69 17.91 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.108 1.872 . . . . 0.0 111.622 -169.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -69.41 -42.65 74.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -66.61 -43.63 84.29 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 41.4 t -55.85 -55.14 19.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.473 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.9 p -63.96 -41.21 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 119.051 0.841 . . . . 0.0 110.556 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -64.01 -43.42 95.68 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.003 0.82 . . . . 0.0 110.235 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.07 -48.06 83.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.378 0.536 . . . . 0.0 110.307 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.9 m -73.68 -26.57 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 119.247 0.93 . . . . 0.0 111.387 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.89 -34.9 74.16 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.739 0.699 . . . . 0.0 111.2 172.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.3 mp -75.83 -30.27 58.92 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.02 0.928 . . . . 0.0 111.947 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 118.535 0.607 . . . . 0.0 109.835 175.074 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 . . . . . 0 C--O 1.236 0.366 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -72.38 -28.12 62.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.071 0.548 . . . . 0.0 110.688 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.49 164.01 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.335 1.054 . . . . 0.0 108.268 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 48.3 mttm -133.1 -31.75 1.25 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 117.589 -1.196 . . . . 0.0 111.949 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.86 165.82 31.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.833 1.197 . . . . 0.0 111.352 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.1 mt -138.08 135.63 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.8 mt -136.03 149.15 48.69 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 58.3 mt -138.75 125.27 24.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.9 mt -127.41 147.05 50.28 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 123.967 0.907 . . . . 0.0 108.964 -169.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -65.68 169.12 6.69 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -68.31 -15.13 63.45 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.626 1.17 . . . . 0.0 110.856 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -76.75 -7.2 54.93 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.062 -1.024 . . . . 0.0 112.06 171.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.18 51.16 29.14 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -169.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -130.32 136.35 49.04 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.578 1.151 . . . . 0.0 109.067 -173.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -60.59 124.28 19.9 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.211 0.605 . . . . 0.0 110.147 -174.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.1 mt -102.48 -41.19 6.38 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 158.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -145.25 151.13 37.9 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.746 0.818 . . . . 0.0 109.413 172.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.99 144.48 13.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.913 0.885 . . . . 0.0 108.69 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -149.7 149.76 31.08 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.869 0.868 . . . . 0.0 108.854 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -135.21 144.27 46.85 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 126.093 1.757 . . . . 0.0 106.786 -174.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -132.85 -8.94 3.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.785 -170.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.33 20.98 7.34 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.248 0.931 . . . . 0.0 112.87 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.2 t70 63.83 12.77 7.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.281 1.832 . . . . 0.0 113.602 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 p -62.84 -44.35 96.38 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.886 1.274 . . . . 0.0 110.555 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -141.0 83.69 13.77 Favored Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 106.409 -1.701 . . . . 0.0 106.409 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -92.5 0.03 3.95 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.667 2.244 . . . . 0.0 113.625 -170.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.0 m -136.24 139.39 42.7 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.195 0.998 . . . . 0.0 109.062 -169.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.7 t -43.83 -53.78 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 126.17 1.788 . . . . 0.0 112.845 -169.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -62.26 -44.21 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.572 0.624 . . . . 0.0 111.05 -173.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.38 -36.12 78.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -64.0 -50.35 68.87 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -56.7 -37.33 70.77 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.47 -0.769 . . . . 0.0 110.954 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.58 -44.82 77.25 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.866 0.466 . . . . 0.0 109.966 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.19 -36.95 83.46 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.4 -0.333 . . . . 0.0 110.645 175.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -65.18 -39.13 92.48 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.558 1.543 . . . . 0.0 111.231 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -64.5 -44.48 90.82 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.474 -0.766 . . . . 0.0 109.919 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.03 -48.15 76.51 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.083 -0.484 . . . . 0.0 110.571 174.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -55.11 -53.93 29.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 124.771 1.228 . . . . 0.0 108.714 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -64.82 -45.96 83.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.088 0.404 . . . . 0.0 110.588 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.44 -44.62 92.9 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 121.938 -0.476 . . . . 0.0 111.315 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtm -64.83 -50.6 66.05 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.4 p -70.84 -30.08 66.4 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.427 -0.796 . . . . 0.0 112.495 -169.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.65 -14.23 60.79 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.73 1.15 . . . . 0.0 113.36 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.43 9.09 21.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.229 1.012 . . . . 0.0 112.321 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.2 m -111.62 157.6 20.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.431 1.092 . . . . 0.0 109.013 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -80.19 30.45 0.27 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.616 1.566 . . . . 0.0 112.971 -170.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.4 m 65.07 -176.8 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.338 1.855 . . . . 0.0 113.635 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.311 10.4 pt-20 56.57 -45.45 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 131.581 3.952 . . . . 0.0 116.84 -176.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.0 tt -154.07 152.49 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 120.626 1.557 . . . . 0.0 110.084 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.08 177.58 9.76 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.81 1.644 . . . . 0.0 108.422 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.5 tt -141.87 122.16 13.94 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 170.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.54 140.77 29.04 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.286 1.034 . . . . 0.0 109.878 -169.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 51.18 28.1 3.88 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.943 1.297 . . . . 0.0 112.215 -176.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.4 -3.27 87.23 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 125.205 1.383 . . . . 0.0 113.816 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.7 mt -106.57 135.26 48.39 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 119.395 1.598 . . . . 0.0 109.226 -174.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 m -73.58 141.46 46.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 173.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.5 p -141.05 137.2 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.702 -0.624 . . . . 0.0 109.699 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.44 148.11 11.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 105.512 -2.032 . . . . 0.0 105.512 169.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 29.2 p90 -155.81 163.79 39.37 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.046 0.451 . . . . 0.0 111.377 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.86 175.89 11.23 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -140.67 142.14 34.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 m -146.16 141.38 27.43 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.832 0.853 . . . . 0.0 109.016 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.4 mp 54.43 -83.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.735 2.014 . . . . 0.0 110.829 -173.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -152.63 28.52 0.55 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.393 1.877 . . . . 0.0 109.482 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.5 tp -132.85 147.37 52.3 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.967 1.707 . . . . 0.0 109.121 -169.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -125.34 141.27 52.17 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -134.49 143.54 47.53 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.865 1.266 . . . . 0.0 108.582 -170.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -147.2 145.61 29.55 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.185 0.994 . . . . 0.0 110.933 -169.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 94.0 t -135.81 129.49 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 169.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -122.04 138.07 53.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 -169.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.66 -175.33 24.86 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 122.287 0.937 . . . . 0.0 112.211 -177.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.411 ' HA ' ' HE2' ' A' ' 14' ' ' LYS . 37.3 m -59.8 159.01 9.47 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.362 1.465 . . . . 0.0 112.28 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.81 25.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 127.483 2.313 . . . . 0.0 112.599 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -73.07 -179.67 3.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.954 1.302 . . . . 0.0 112.495 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -113.61 29.98 7.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.513 1.525 . . . . 0.0 113.066 -169.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.445 ' C ' ' H ' ' A' ' 88' ' ' LEU . 2.7 p30 -128.41 -39.51 1.67 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 116.563 -1.684 . . . . 0.0 113.592 169.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.251 8.6 pm0 49.79 -16.73 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 128.36 2.664 . . . . 0.0 117.441 -173.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 86' ' ' ASN . 35.5 mt -58.98 -34.23 71.59 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 127.213 2.205 . . . . 0.0 110.893 177.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -65.57 -34.09 77.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.257 0.935 . . . . 0.0 111.738 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.0 mt -68.46 -46.88 68.6 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -53.18 -42.95 66.72 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.17 0.988 . . . . 0.0 109.958 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.33 -50.23 68.59 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.379 1.472 . . . . 0.0 110.265 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.67 -42.92 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 118.651 0.659 . . . . 0.0 110.168 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.76 -49.49 76.2 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.753 0.706 . . . . 0.0 110.488 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.06 -43.69 98.5 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.098 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.7 m -61.07 -46.1 92.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.529 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 tp -65.56 -46.4 79.64 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 119.756 1.162 . . . . 0.0 110.982 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -64.06 -42.82 96.88 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.031 0.443 . . . . 0.0 110.771 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -68.57 -38.81 81.04 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.536 -0.728 . . . . 0.0 110.959 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.1 m -60.9 -48.96 79.43 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.261 0.624 . . . . 0.0 110.666 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.7 mt -50.92 -49.29 59.93 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.844 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -68.23 -53.78 22.3 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.668 1.122 . . . . 0.0 111.032 178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 13.4 ptt? -70.63 -30.18 66.75 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.613 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.9 mt -75.99 -43.06 46.23 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.59 0.632 . . . . 0.0 112.171 174.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 51.54 36.22 16.49 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.505 1.122 . . . . 0.0 110.793 -169.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -150.05 170.9 17.8 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 127.074 2.149 . . . . 0.0 107.045 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -57.55 132.68 53.92 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.262 0.625 . . . . 0.0 109.799 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.9 m -89.37 42.08 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 124.579 1.152 . . . . 0.0 111.115 -169.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.6 178.02 1.09 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.619 1.168 . . . . 0.0 112.113 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -46.41 -54.63 8.75 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.455 1.102 . . . . 0.0 111.778 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -63.27 -42.15 99.11 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.715 0.234 . . . . 0.0 111.614 -176.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.312 0.0 OUTLIER -79.55 -31.98 42.08 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.409 -1.432 . . . . 0.0 111.254 175.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.99 -41.72 92.68 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.815 0.734 . . . . 0.0 111.269 170.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -74.48 -10.62 59.74 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.592 -0.693 . . . . 0.0 112.607 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.96 27.32 4.9 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.472 1.109 . . . . 0.0 112.878 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.1 mmt -43.17 -43.9 4.85 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.741 1.216 . . . . 0.0 112.723 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -63.81 -42.22 97.72 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.203 0.91 . . . . 0.0 111.211 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.3 96.4 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 tp -55.61 -51.9 65.61 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.844 1.257 . . . . 0.0 110.219 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -57.43 -47.32 82.1 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.013 0.525 . . . . 0.0 109.613 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 69.5 mt -65.0 -39.22 93.13 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.091 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.97 -44.33 89.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.843 0.747 . . . . 0.0 110.563 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 39.9 t -56.28 -48.24 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.53 6.8 0.98 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.52 1.528 . . . . 0.0 113.57 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -126.16 -23.28 3.91 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.743 1.617 . . . . 0.0 110.682 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 48.0 mt -84.35 -37.78 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.9 159.35 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 119.797 1.181 . . . . 0.0 111.239 -172.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -159.99 138.03 10.08 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.482 1.513 . . . . 0.0 108.366 169.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.59 26.53 57.3 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-O 119.434 -0.648 . . . . 0.0 114.464 171.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.49 13.77 75.28 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-N 118.215 1.007 . . . . 0.0 113.13 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 t -128.84 141.46 46.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 29.8 pt -64.16 158.95 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.734 0.778 . . . . 0.0 110.071 170.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.7 mt -116.98 -39.9 3.19 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.714 1.606 . . . . 0.0 108.769 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -155.68 160.97 40.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.624 1.169 . . . . 0.0 108.419 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.5 p -138.03 37.88 2.35 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.658 1.583 . . . . 0.0 109.799 -173.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -136.1 120.13 12.75 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.48 -34.11 6.14 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.355 2.037 . . . . 0.0 112.149 -170.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -67.23 -45.66 76.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -65.73 -38.73 89.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.668 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 5.0 t -56.48 -53.58 38.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 119.141 0.882 . . . . 0.0 109.895 173.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 70.7 t -64.57 -36.49 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.725 1.148 . . . . 0.0 110.372 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.32 -50.81 72.29 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.989 0.813 . . . . 0.0 110.239 174.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.1 mtt-85 -59.54 -43.46 93.51 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 111.102 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 51.1 t -59.0 -43.6 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.624 1.102 . . . . 0.0 110.048 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.2 -32.66 70.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.024 0.53 . . . . 0.0 111.691 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.9 tp -73.49 -28.65 62.04 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.268 1.827 . . . . 0.0 112.268 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 123.735 0.814 . . . . 0.0 109.891 175.643 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 . . . . . 0 C--O 1.235 0.293 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 m -71.94 -38.75 69.76 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 168.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -141.78 135.26 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 126.452 1.901 . . . . 0.0 106.555 175.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -92.55 -36.66 12.91 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 0.0 110.736 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.67 167.29 28.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.996 0.816 . . . . 0.0 111.947 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.3 mt -135.33 135.4 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 104.893 -2.262 . . . . 0.0 104.893 171.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.6 mt -133.02 148.68 52.24 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 57.5 mt -136.78 113.18 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 102.763 -3.051 . . . . 0.0 102.763 169.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.2 mt -122.06 146.95 46.7 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.401 0.68 . . . . 0.0 109.678 -169.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.41 169.81 5.53 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 168.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -14.87 59.75 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.38 1.072 . . . . 0.0 112.413 173.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -75.22 -9.33 58.45 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.193 0.997 . . . . 0.0 112.139 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.83 51.47 15.09 Favored Glycine 0 C--N 1.339 0.737 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -140.06 133.45 29.97 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.259 1.023 . . . . 0.0 108.684 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 124.84 22.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.279 0.491 . . . . 0.0 111.609 -170.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.8 mt -82.45 -37.42 25.44 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 153.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -145.55 151.97 38.98 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.055 1.342 . . . . 0.0 108.853 170.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -154.7 147.57 24.49 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -138.34 135.16 35.1 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 171.429 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -123.54 129.77 51.68 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -103.66 -24.51 13.36 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -55.07 158.46 2.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.086 2.554 . . . . 0.0 112.575 169.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -119.52 1.39 11.16 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.795 1.638 . . . . 0.0 111.867 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 m -75.81 -35.25 60.08 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.792 1.237 . . . . 0.0 110.084 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -130.15 67.91 80.37 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 125.287 1.435 . . . . 0.0 108.784 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -89.14 -1.38 6.21 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.814 2.343 . . . . 0.0 113.713 -173.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 m -137.63 148.92 46.2 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.894 0.878 . . . . 0.0 110.313 -169.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.7 t -45.54 -53.61 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 126.327 1.851 . . . . 0.0 112.733 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -54.61 -47.94 72.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 118.593 0.633 . . . . 0.0 111.064 -175.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -75.47 -34.16 60.88 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 -176.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -63.07 -46.81 85.7 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.815 0.846 . . . . 0.0 110.625 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -63.86 -34.24 77.49 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.281 0.946 . . . . 0.0 111.068 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -47.22 78.33 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.903 -0.498 . . . . 0.0 109.897 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -61.6 -40.02 93.3 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.95 0.9 . . . . 0.0 110.805 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -57.41 -49.9 74.74 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.654 1.581 . . . . 0.0 111.168 172.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -62.4 -40.96 98.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.808 1.186 . . . . 0.0 110.53 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -48.46 77.96 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.028 0.531 . . . . 0.0 110.641 173.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.6 mt -60.85 -48.05 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.08 0 C-N-CA 123.712 0.805 . . . . 0.0 109.481 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -58.84 -45.91 88.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.484 0.714 . . . . 0.0 110.158 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -63.02 -42.13 99.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.857 0.463 . . . . 0.0 112.066 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -68.86 -50.46 49.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.885 0.474 . . . . 0.0 110.471 -177.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.5 p -61.55 -35.15 76.96 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 123.733 0.813 . . . . 0.0 112.89 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.45 0.3 3.11 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -119.93 33.48 5.6 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.307 1.443 . . . . 0.0 109.761 -171.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.4 p -135.97 -174.4 3.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.069 0.948 . . . . 0.0 111.116 -169.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -78.63 6.02 9.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.77 1.228 . . . . 0.0 111.814 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m 68.79 31.25 4.51 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.264 1.826 . . . . 0.0 115.347 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.46 -16.69 4.31 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.917 0.487 . . . . 0.0 111.154 169.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.1 tt -164.74 156.28 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.361 1.064 . . . . 0.0 109.127 -171.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.82 171.81 14.62 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.351 1.861 . . . . 0.0 108.965 170.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -131.94 116.76 17.56 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.5 mt -78.15 -128.49 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.18 1.392 . . . . 0.0 108.535 -175.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -82.16 2.47 31.38 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.127 -0.983 . . . . 0.0 111.698 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.16 -33.29 0.51 Allowed Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.951 1.739 . . . . 0.0 110.474 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.0 mt -67.06 155.42 38.73 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.836 0.854 . . . . 0.0 109.423 173.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 55.8 m -112.45 145.2 40.6 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -138.56 130.32 37.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.0 m -97.45 146.04 8.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -156.49 167.14 31.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.124 0.42 . . . . 0.0 111.021 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -155.19 178.59 10.03 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.616 1.166 . . . . 0.0 108.103 169.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.1 p -142.42 148.59 38.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.91 0.484 . . . . 0.0 109.847 170.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.1 m -146.74 143.21 28.53 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.833 1.253 . . . . 0.0 108.936 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.2 mp 52.5 -87.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.507 1.923 . . . . 0.0 111.141 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -144.9 16.86 1.59 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.589 1.956 . . . . 0.0 109.76 -178.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.4 tp -120.22 144.07 47.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.971 2.108 . . . . 0.0 108.397 -169.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -122.55 146.02 47.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -135.51 137.47 42.14 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 -171.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -146.66 150.64 35.82 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.883 0.873 . . . . 0.0 110.529 -171.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 83.9 t -140.39 129.75 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.53 144.13 27.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -162.2 -175.76 33.57 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 121.814 0.674 . . . . 0.0 112.203 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 155.31 23.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.192 1.397 . . . . 0.0 111.343 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -56.23 -46.61 79.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.189 0.996 . . . . 0.0 110.677 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 15.0 t80 51.07 -169.83 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.204 2.202 . . . . 0.0 112.935 173.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -82.72 -18.29 41.34 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.356 -0.84 . . . . 0.0 111.405 175.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -157.49 176.94 12.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 125.478 1.511 . . . . 0.0 109.662 -175.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.79 4.18 8.13 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.119 2.167 . . . . 0.0 110.512 -174.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.8 mt -69.63 -32.4 71.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.558 1.143 . . . . 0.0 111.093 -173.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -34.16 77.53 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.248 0.931 . . . . 0.0 111.149 173.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.1 mt -66.76 -48.3 69.52 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.8 mmt -54.34 -42.85 70.71 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.029 0.531 . . . . 0.0 110.335 174.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.6 84.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.707 0.803 . . . . 0.0 110.502 -177.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.72 -43.67 96.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.062 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.9 tp -61.2 -49.15 78.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.131 0.878 . . . . 0.0 110.417 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -63.48 -42.91 98.55 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.306 -178.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.56 -51.89 67.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.66 -47.52 83.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.439 0.563 . . . . 0.0 110.26 -176.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -65.4 -40.16 93.06 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.976 0.353 . . . . 0.0 111.497 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -71.72 -32.87 68.23 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.266 -0.896 . . . . 0.0 111.191 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -61.06 -49.89 75.5 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.685 0.794 . . . . 0.0 110.268 174.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.8 mt -52.44 -51.24 60.23 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -59.05 -19.68 46.32 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -84.78 -55.08 4.28 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 120.637 1.562 . . . . 0.0 110.44 171.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 23.0 ptt? -78.11 -7.44 57.0 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -171.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 30.0 tp -144.68 59.35 1.32 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 127.291 2.236 . . . . 0.0 106.124 -171.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -52.55 -17.69 1.37 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.092 . . . . 0.0 114.929 -170.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -66.14 -166.15 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.45 1.023 . . . . 0.0 111.217 170.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -76.8 9.13 3.05 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.257 24.0 m 42.76 41.69 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 125.84 1.656 . . . . 0.0 112.914 -175.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -75.52 176.16 7.84 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.262 1.025 . . . . 0.0 111.184 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -49.85 -49.59 48.62 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.133 0.973 . . . . 0.0 112.972 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -62.9 -40.37 97.36 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.037 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.19 94.24 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.509 0.595 . . . . 0.0 110.305 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -59.78 -49.76 76.45 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.874 0.87 . . . . 0.0 110.107 175.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.33 -40.43 74.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.693 1.197 . . . . 0.0 110.98 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.87 -14.12 62.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.822 0.849 . . . . 0.0 113.086 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -133.72 22.38 3.93 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.919 0.887 . . . . 0.0 112.284 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.3 mmt -45.6 -45.37 13.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.301 1.44 . . . . 0.0 111.872 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.85 -40.29 94.92 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.433 1.015 . . . . 0.0 111.7 -177.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.0 -42.23 94.81 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 177.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 tp -57.09 -51.26 69.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.235 1.014 . . . . 0.0 110.493 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -55.5 -46.86 76.92 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.337 0.655 . . . . 0.0 109.286 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.57 -41.83 96.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.893 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -59.82 -45.35 92.66 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.613 1.097 . . . . 0.0 110.496 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.26 -42.71 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.616 0.644 . . . . 0.0 109.831 175.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -66.17 -26.34 67.37 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.376 0.67 . . . . 0.0 112.804 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -79.47 -34.67 41.23 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.163 0.892 . . . . 0.0 110.892 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 81.4 mt -79.56 -40.36 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.015 -174.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.6 t -133.9 145.56 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.302 0.955 . . . . 0.0 110.166 -169.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -146.16 131.92 19.0 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.415 1.486 . . . . 0.0 107.456 169.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.56 25.1 54.73 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 123.555 0.598 . . . . 0.0 113.705 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.09 22.92 78.65 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.241 1.02 . . . . 0.0 113.387 -177.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 58.5 t -128.73 140.43 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 176.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.0 pt -69.08 159.36 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-O 121.377 0.608 . . . . 0.0 110.395 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.8 mt -121.71 -34.2 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.136 1.375 . . . . 0.0 109.512 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -156.09 158.18 37.29 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.743 1.217 . . . . 0.0 108.477 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.5 m -135.5 -3.81 2.35 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.664 1.585 . . . . 0.0 111.627 177.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -77.26 116.34 56.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 119.316 0.962 . . . . 0.0 108.743 169.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.65 -33.91 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.563 2.176 . . . . 0.0 112.109 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -68.04 -44.41 76.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -68.36 -34.57 76.31 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.171 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.76 -51.6 68.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 119.182 0.901 . . . . 0.0 109.587 170.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 63.8 t -63.19 -36.92 77.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.768 1.167 . . . . 0.0 110.613 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -46.84 87.95 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.197 0.908 . . . . 0.0 110.154 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 48.0 mtp180 -60.01 -44.51 94.54 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.089 175.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 78.1 t -58.48 -46.33 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 119.697 1.135 . . . . 0.0 109.707 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.53 -33.11 74.4 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.358 0.663 . . . . 0.0 111.663 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 64.7 tp -71.35 -31.42 67.32 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.93 1.692 . . . . 0.0 111.644 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.947 175.651 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 . . . . . 0 C--O 1.236 0.373 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -68.33 -31.08 70.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.428 0.558 . . . . 0.0 109.622 176.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.49 125.97 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 169.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -81.05 -32.18 34.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 117.986 -1.007 . . . . 0.0 109.091 171.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.56 168.15 26.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.961 0.8 . . . . 0.0 111.735 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.9 mt -136.65 138.02 46.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 104.303 -2.48 . . . . 0.0 104.303 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mt -137.0 151.0 48.47 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -138.19 120.2 18.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 103.343 -2.836 . . . . 0.0 103.343 169.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.7 mt -126.05 147.0 49.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.45 169.41 6.01 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.181 0.515 . . . . 0.0 110.845 171.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -9.66 0.65 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 116.572 2.064 . . . . 0.0 116.572 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -119.95 9.37 11.24 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.145 1.378 . . . . 0.0 110.586 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.24 19.6 54.83 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.635 1.112 . . . . 0.0 112.469 173.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.4 133.28 39.94 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.358 1.579 . . . . 0.0 109.671 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -55.89 126.02 23.9 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.111 0.965 . . . . 0.0 108.98 176.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.3 mt -116.81 -45.73 2.77 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 165.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -143.83 152.69 41.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.54 148.63 19.76 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -141.7 136.12 30.52 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 171.075 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -125.73 146.82 49.59 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -130.61 -34.11 1.58 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.914 0.886 . . . . 0.0 111.329 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -78.93 159.59 27.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 172.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -78.53 7.79 6.19 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.935 1.694 . . . . 0.0 111.95 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 p -64.69 -45.99 84.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.244 1.418 . . . . 0.0 111.42 -177.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.9 70.88 29.5 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.338 1.055 . . . . 0.0 109.213 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -86.26 -1.46 8.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.573 2.182 . . . . 0.0 113.538 -173.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.8 m -134.52 138.35 44.59 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.126 0.97 . . . . 0.0 109.684 -169.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.0 t -46.31 -49.05 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.299 1.839 . . . . 0.0 112.937 -169.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -57.15 -46.57 82.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.383 0.538 . . . . 0.0 110.816 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.27 -32.07 60.93 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.286 -0.259 . . . . 0.0 110.349 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -62.72 -51.25 67.92 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 122.941 0.496 . . . . 0.0 110.203 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -59.64 -34.29 72.61 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.566 -0.708 . . . . 0.0 110.764 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.1 -47.28 74.72 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.745 0.418 . . . . 0.0 109.954 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -61.14 -36.63 80.29 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.829 0.451 . . . . 0.0 110.916 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -65.77 -40.94 92.51 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.17 1.388 . . . . 0.0 111.276 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -66.68 -39.24 88.04 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.245 0.93 . . . . 0.0 110.109 173.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -48.74 76.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.992 0.517 . . . . 0.0 110.622 171.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -56.74 -54.6 27.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.109 0 C-N-CA 124.475 1.11 . . . . 0.0 108.513 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -58.72 -48.78 79.97 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.328 0.651 . . . . 0.0 110.208 -176.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -60.74 -45.13 95.48 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.319 0.648 . . . . 0.0 111.894 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -70.02 -48.9 56.14 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 34.5 p -67.5 -28.18 67.62 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.591 -0.693 . . . . 0.0 112.088 -174.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.34 -18.76 60.19 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 118.796 0.725 . . . . 0.0 111.896 174.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtt-85 -113.76 19.22 16.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.751 1.62 . . . . 0.0 110.482 -172.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.3 m -131.49 154.44 48.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.759 1.224 . . . . 0.0 109.07 -169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.79 88.73 4.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.31 1.044 . . . . 0.0 109.306 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.9 m -46.66 136.95 7.35 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 126.171 1.788 . . . . 0.0 115.808 -169.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.74 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 1 C-N-CA 133.031 4.533 . . . . 0.0 107.75 172.093 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 tt -153.43 158.92 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.386 1.474 . . . . 0.0 108.569 178.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.34 165.04 34.28 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.72 2.008 . . . . 0.0 108.778 173.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -131.21 104.32 6.99 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 102.16 -3.274 . . . . 0.0 102.16 170.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -76.65 -64.87 1.02 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -168.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -141.77 6.55 1.83 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.837 1.655 . . . . 0.0 110.617 -173.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.4 -39.13 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 126.442 1.972 . . . . 0.0 109.169 -173.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.6 mt -72.98 132.98 44.11 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.406 0.682 . . . . 0.0 109.869 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.2 m -83.41 142.91 30.65 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.8 t -135.67 138.13 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.15 133.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.6 p90 -156.73 164.31 38.27 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -169.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -152.33 177.47 10.54 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.698 1.199 . . . . 0.0 108.989 172.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.0 p -143.66 147.87 34.94 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.255 0.622 . . . . 0.0 109.38 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.0 m -146.97 137.99 23.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.483 1.113 . . . . 0.0 108.894 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 mp 53.16 -84.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 127.483 2.313 . . . . 0.0 112.551 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -143.92 23.29 1.73 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.795 1.638 . . . . 0.0 109.552 -176.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 tp -132.04 145.35 51.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.63 1.572 . . . . 0.0 109.152 -169.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -125.85 146.11 49.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.41 138.45 46.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -144.3 148.81 35.29 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 123.568 0.747 . . . . 0.0 110.109 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -134.44 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 104.432 -2.433 . . . . 0.0 104.432 170.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.27 134.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -173.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -156.98 177.08 34.05 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-O 122.398 0.999 . . . . 0.0 113.172 -177.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.3 m -63.68 164.36 9.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 112.867 -1.666 . . . . 0.0 109.5 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -128.09 28.23 5.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.943 0.897 . . . . 0.0 110.597 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -60.37 -40.91 92.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.738 0.815 . . . . 0.0 112.968 -169.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -156.19 -23.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -145.9 165.77 27.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.339 0.972 . . . . 0.0 111.634 -171.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.8 -7.55 5.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.327 2.651 . . . . 0.0 110.326 177.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.66 -33.27 72.56 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.664 1.186 . . . . 0.0 110.775 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -64.09 -34.28 77.69 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.135 0.88 . . . . 0.0 111.819 174.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.22 -42.02 63.11 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.9 mmt -58.2 -40.75 82.37 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.521 171.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.06 -50.13 71.83 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.827 0.851 . . . . 0.0 109.815 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.42 -45.07 99.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 118.918 -0.563 . . . . 0.0 109.94 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 39.3 tp -60.47 -48.89 79.8 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.475 0.579 . . . . 0.0 110.304 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.46 -44.87 93.22 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.381 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 87.7 m -62.78 -43.85 97.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.523 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.9 tp -64.68 -51.73 60.93 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.785 0.72 . . . . 0.0 110.158 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -61.31 -42.04 97.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.396 0.278 . . . . 0.0 110.701 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.98 -38.56 66.62 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.593 -0.692 . . . . 0.0 111.483 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 m -61.51 -43.89 98.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.133 0.879 . . . . 0.0 110.379 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 mt -57.71 -45.76 85.31 Favored 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.2 m -61.4 -26.4 67.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.829 -0.605 . . . . 0.0 112.235 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -75.34 -53.13 9.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.819 1.19 . . . . 0.0 110.365 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 3.0 ptp -69.85 -39.42 76.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.012 0.824 . . . . 0.0 112.076 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.27 -37.82 60.76 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.532 0.606 . . . . 0.0 110.172 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 48.11 33.53 3.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.47 1.508 . . . . 0.0 113.028 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -153.31 -172.21 4.16 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.92 2.088 . . . . 0.0 107.421 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -50.0 122.9 7.26 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.804 0.842 . . . . 0.0 109.322 173.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 m -78.03 40.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 C-N-CA 125.029 1.332 . . . . 0.0 110.251 170.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.19 172.56 12.64 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.673 1.189 . . . . 0.0 112.231 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -43.77 -60.23 1.89 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.981 2.112 . . . . 0.0 112.874 -177.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -63.11 -46.11 88.87 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.726 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.71 82.08 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.943 0.792 . . . . 0.0 111.405 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.3 mp -74.14 -36.21 64.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.978 175.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.3 tp -58.63 -37.19 75.39 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.162 0.892 . . . . 0.0 110.956 171.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -73.9 -15.42 61.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 175.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -124.58 25.87 7.41 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.581 1.082 . . . . 0.0 111.454 -173.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.32 -48.63 18.25 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.908 1.283 . . . . 0.0 112.007 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.98 -39.51 94.3 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.721 0.691 . . . . 0.0 111.343 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.97 96.74 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.03 -50.6 72.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.609 1.163 . . . . 0.0 110.357 174.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -55.41 -48.07 74.93 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.028 0.531 . . . . 0.0 109.816 178.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.9 mt -65.56 -37.8 87.73 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.17 0.588 . . . . 0.0 111.397 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.37 -47.08 83.58 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 118.872 0.76 . . . . 0.0 109.906 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.95 -46.21 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.3 -2.92 4.92 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.125 1.37 . . . . 0.0 113.804 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -117.16 -12.94 10.52 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.749 1.22 . . . . 0.0 112.005 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 59.8 mt -87.9 -40.39 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.278 0.945 . . . . 0.0 108.503 173.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.32 156.24 21.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 124.936 1.294 . . . . 0.0 109.901 -172.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -149.8 136.44 19.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.252 1.421 . . . . 0.0 107.217 169.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.97 29.07 50.62 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 119.242 -0.755 . . . . 0.0 113.182 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.08 10.67 85.28 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 118.299 1.049 . . . . 0.0 113.835 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.12 133.33 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-N 119.079 1.439 . . . . 0.0 107.265 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.1 pt -57.77 145.15 9.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.085 0.554 . . . . 0.0 110.393 173.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -133.81 -14.22 2.46 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.202 1.001 . . . . 0.0 112.018 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -149.86 159.88 44.02 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.9 m -150.69 41.81 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.874 1.27 . . . . 0.0 109.464 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -139.94 119.86 9.05 Favored Pre-proline 0 C--O 1.235 0.325 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 173.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -30.82 13.18 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.056 1.837 . . . . 0.0 112.114 -169.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.18 -41.47 85.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -68.27 -42.1 80.08 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.473 0.579 . . . . 0.0 109.685 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 28.6 t -55.96 -55.8 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 118.845 -0.597 . . . . 0.0 109.471 176.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 5.2 p -65.26 -33.16 61.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 119.604 1.093 . . . . 0.0 110.798 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -60.59 -44.32 96.38 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.177 0.899 . . . . 0.0 110.566 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -63.57 -42.65 98.3 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.469 -0.769 . . . . 0.0 110.935 175.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.1 t -58.18 -42.2 82.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.968 0.804 . . . . 0.0 109.745 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.11 77.46 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.578 0.751 . . . . 0.0 111.902 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.94 -39.22 79.68 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.479 0.711 . . . . 0.0 111.386 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 54.9 mtp180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.427 -176.487 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 120.84 0.352 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.6 m -58.1 -35.56 71.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.699 1.599 . . . . 0.0 110.649 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -155.24 151.34 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -117.27 -30.42 5.6 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 117.585 -1.198 . . . . 0.0 111.747 -173.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.58 166.6 26.71 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 119.837 1.199 . . . . 0.0 111.656 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.1 mt -137.03 136.45 47.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -133.3 148.22 51.91 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.7 mt -139.06 118.18 13.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 169.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.4 mt -122.68 146.71 47.23 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -173.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 168.81 8.16 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.219 0.533 . . . . 0.0 110.31 169.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -12.23 1.54 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -115.97 3.64 13.69 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.94 1.296 . . . . 0.0 110.919 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.99 5.23 55.06 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.073 1.32 . . . . 0.0 113.084 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -69.8 133.76 47.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.426 1.613 . . . . 0.0 109.89 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -61.15 123.87 18.94 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 118.504 0.593 . . . . 0.0 109.653 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -100.08 -40.86 7.4 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 162.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -150.09 152.93 35.55 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.458 172.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.17 146.84 19.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 168.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.452 ' HE2' ' H ' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -147.46 146.78 29.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 170.437 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.452 ' H ' ' HE2' ' A' ' 29' ' ' LYS . 79.7 m-85 -133.6 151.72 51.75 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.969 1.708 . . . . 0.0 106.662 -177.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -135.92 1.4 2.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.869 0.868 . . . . 0.0 111.887 -175.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -133.68 158.31 43.59 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.737 0.815 . . . . 0.0 109.447 -176.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.52 5.19 3.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.358 2.263 . . . . 0.0 112.609 -173.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 p -62.21 -50.09 73.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.645 1.178 . . . . 0.0 110.532 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -142.68 64.71 15.84 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 124.193 0.997 . . . . 0.0 109.992 -174.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -82.18 -2.02 11.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.778 2.319 . . . . 0.0 113.598 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.5 m -138.01 143.68 40.71 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.914 0.886 . . . . 0.0 110.287 -169.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.8 t -45.62 -51.3 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 126.491 1.916 . . . . 0.0 113.127 -169.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -58.67 -46.64 86.75 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.799 0.727 . . . . 0.0 110.893 -176.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -70.37 -34.48 72.65 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.639 0.376 . . . . 0.0 110.165 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -63.2 -52.04 63.87 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.231 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -60.18 -35.35 75.17 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.894 0.77 . . . . 0.0 111.348 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.15 -49.92 70.24 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -63.4 -39.47 94.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.589 0.355 . . . . 0.0 111.023 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.07 -40.55 98.03 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.927 1.691 . . . . 0.0 111.564 178.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -69.32 -40.96 77.32 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.648 -0.657 . . . . 0.0 110.001 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.12 -48.78 73.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.979 0.512 . . . . 0.0 110.557 171.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.9 mm -54.86 -59.92 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 C-N-CA 125.133 1.373 . . . . 0.0 108.092 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -57.65 -45.33 85.62 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.629 0.772 . . . . 0.0 111.323 -172.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -57.84 -52.92 63.5 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 122.687 0.395 . . . . 0.0 110.507 176.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -63.9 -45.83 87.57 Favored 'General case' 0 C--O 1.23 0.062 0 CA-C-O 119.431 -0.318 . . . . 0.0 110.191 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.2 p -68.27 -32.06 71.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 119.205 0.911 . . . . 0.0 111.996 -172.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -73.51 0.55 12.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.442 1.019 . . . . 0.0 112.981 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -136.92 35.42 2.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.948 1.299 . . . . 0.0 110.451 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.3 m -135.88 156.98 47.95 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.387 1.875 . . . . 0.0 108.14 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -80.17 86.09 5.64 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.327 1.051 . . . . 0.0 109.055 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.7 m -50.57 144.27 8.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -169.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 145.45 -42.84 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 1 C-N-CA 133.553 4.741 . . . . 0.0 105.823 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -157.35 160.15 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.748 1.219 . . . . 0.0 108.973 -178.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.23 174.57 15.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.894 1.678 . . . . 0.0 110.207 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -136.7 116.89 13.46 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 176.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.2 mp -127.63 117.79 22.66 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.236 1.414 . . . . 0.0 107.296 -172.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 50.68 31.49 5.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.121 1.368 . . . . 0.0 112.765 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.03 -16.03 61.59 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.859 1.218 . . . . 0.0 113.471 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.0 mt -91.21 134.15 34.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.456 1.628 . . . . 0.0 109.258 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 61.3 m -76.18 141.82 41.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 172.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.2 t -133.67 137.87 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -128.65 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 174.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -158.19 164.72 36.26 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.292 0.496 . . . . 0.0 112.218 -169.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -148.42 171.54 15.88 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.756 1.222 . . . . 0.0 108.352 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 p -145.47 143.91 30.29 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 169.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 17.1 m -147.24 142.89 27.71 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 109.665 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.4 mt 63.87 -81.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.382 1.873 . . . . 0.0 111.68 169.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -151.61 27.26 0.65 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.354 1.861 . . . . 0.0 109.151 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.2 tp -138.98 147.35 42.07 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.967 1.707 . . . . 0.0 110.062 -168.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -129.53 144.99 51.5 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.364 1.466 . . . . 0.0 107.454 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -132.85 137.19 46.63 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.433 1.493 . . . . 0.0 107.236 -172.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -146.13 151.19 37.27 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.728 0.695 . . . . 0.0 110.479 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.0 t -138.22 141.58 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 105.018 -2.215 . . . . 0.0 105.018 169.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.22 141.12 44.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 -172.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.89 -178.91 36.2 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 121.739 0.633 . . . . 0.0 113.062 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -62.57 164.8 7.04 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 113.973 -1.114 . . . . 0.0 110.205 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.1 m -124.68 43.96 2.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.866 0.866 . . . . 0.0 111.021 -169.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -71.91 -166.64 0.23 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 122.863 0.465 . . . . 0.0 110.21 169.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -58.41 -3.6 0.3 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 117.049 2.24 . . . . 0.0 117.049 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.69 167.69 25.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 120.27 1.396 . . . . 0.0 111.211 176.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.82 -0.91 2.78 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.486 2.715 . . . . 0.0 110.295 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.8 mt -63.65 -32.55 74.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.792 1.237 . . . . 0.0 109.937 -175.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -34.53 78.51 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.896 0.771 . . . . 0.0 111.355 175.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 mt -70.57 -45.19 65.87 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.5 mtp -58.94 -37.43 76.71 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.832 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.13 74.02 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.776 0.83 . . . . 0.0 110.364 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.6 t -59.05 -46.34 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.7 tp -58.05 -49.96 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.993 0.517 . . . . 0.0 110.366 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -63.6 -43.55 96.6 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 119.116 -0.469 . . . . 0.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.3 m -64.21 -42.18 96.73 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.491 0.587 . . . . 0.0 110.709 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.3 tp -67.93 -46.62 71.0 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.638 0.654 . . . . 0.0 110.241 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -62.34 -42.95 99.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.679 0.392 . . . . 0.0 111.046 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -76.58 -37.93 55.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.364 -0.835 . . . . 0.0 111.174 -176.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.7 p -63.13 -39.67 95.35 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.641 1.11 . . . . 0.0 110.442 175.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 11.6 mt -54.35 -52.64 60.96 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 m -56.21 -33.42 65.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.885 0.474 . . . . 0.0 111.928 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -69.25 -59.24 3.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.086 173.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.6 ptt? -69.6 -31.52 69.71 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.061 1.301 . . . . 0.0 113.472 -169.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.84 -35.42 74.73 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.824 0.738 . . . . 0.0 111.794 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? 49.08 33.29 4.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.424 1.09 . . . . 0.0 112.039 -171.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -155.21 175.66 13.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.076 2.151 . . . . 0.0 106.585 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -62.48 136.31 57.84 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -76.16 51.97 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.204 1.802 . . . . 0.0 111.02 -174.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.08 169.99 17.36 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.508 1.123 . . . . 0.0 111.745 -177.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -47.47 -55.42 9.09 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.366 1.866 . . . . 0.0 112.799 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -66.36 -38.27 87.19 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.221 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.76 -35.84 82.38 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.337 0.971 . . . . 0.0 110.864 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.99 -42.88 80.12 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 118.94 0.791 . . . . 0.0 110.685 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 58.1 tp -58.26 -37.4 74.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.667 0.667 . . . . 0.0 111.211 176.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -69.61 -18.45 63.61 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.104 0.962 . . . . 0.0 113.011 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -126.23 24.67 6.8 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.225 1.01 . . . . 0.0 111.525 -171.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -44.35 -49.34 9.6 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.475 1.51 . . . . 0.0 112.424 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.63 -42.48 98.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.205 0.911 . . . . 0.0 110.952 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.95 -43.88 98.24 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.14 -50.46 73.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.391 1.076 . . . . 0.0 110.837 175.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -55.06 -48.78 73.0 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.383 0.673 . . . . 0.0 109.871 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 97.1 mt -71.27 -32.27 68.5 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.416 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.46 -44.56 96.12 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.288 0.949 . . . . 0.0 109.71 173.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.35 -47.89 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 118.794 0.725 . . . . 0.0 109.638 174.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -61.12 -26.73 67.87 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -87.9 -28.95 21.22 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.118 0.967 . . . . 0.0 111.515 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.11 -43.35 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-N 119.089 0.859 . . . . 0.0 109.507 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 p -142.01 146.77 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.03 0.932 . . . . 0.0 110.39 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -144.49 138.93 27.95 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.02 1.328 . . . . 0.0 107.424 169.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.73 29.53 49.72 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.573 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.48 19.88 79.73 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 118.201 1.001 . . . . 0.0 113.417 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 61.3 t -130.94 133.59 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.6 pt -64.61 146.91 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.84 -12.35 3.75 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.888 0.875 . . . . 0.0 111.401 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.87 156.0 43.26 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 169.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.7 m -151.76 41.66 0.69 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.422 1.089 . . . . 0.0 109.735 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -142.36 120.5 7.44 Favored Pre-proline 0 C--O 1.235 0.299 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 174.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.81 -28.93 19.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.237 1.958 . . . . 0.0 111.775 -169.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -70.98 -39.96 72.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.78 -41.39 75.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 118.89 0.768 . . . . 0.0 109.609 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 42.1 t -55.3 -56.27 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.16 -34.6 71.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 118.979 0.809 . . . . 0.0 110.819 -174.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -59.17 -50.77 72.76 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.039 0.836 . . . . 0.0 109.904 176.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -62.05 -40.3 95.29 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.881 -0.512 . . . . 0.0 111.135 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 65.3 t -64.07 -37.48 79.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.777 0.717 . . . . 0.0 110.654 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.35 -37.71 71.67 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.755 1.162 . . . . 0.0 111.071 175.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.0 tp -70.18 -26.09 63.74 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.48 1.912 . . . . 0.0 112.698 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 C-N-CA 124.861 1.264 . . . . 0.0 112.184 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 . . . . . 0 C--O 1.234 0.269 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 m -65.35 -41.21 94.08 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 169.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -139.36 139.3 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 123.85 0.86 . . . . 0.0 108.739 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -83.53 -37.83 22.53 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 169.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.61 168.28 20.17 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 118.513 0.597 . . . . 0.0 112.125 -173.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mt -133.28 137.47 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 104.94 -2.244 . . . . 0.0 104.94 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.9 mt -133.76 157.7 45.2 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.521 0.728 . . . . 0.0 109.373 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.8 mm -138.31 119.77 17.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.368 -2.827 . . . . 0.0 103.368 169.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -122.54 144.73 48.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.705 0.764 . . . . 0.0 109.158 -174.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -67.87 169.7 9.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.767 169.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -77.22 36.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.883 2.073 . . . . 0.0 111.389 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -149.62 7.26 0.65 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.278 2.231 . . . . 0.0 110.816 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.19 47.1 74.9 Favored Glycine 0 C--N 1.343 0.946 0 O-C-N 121.053 -1.029 . . . . 0.0 110.548 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -122.99 133.26 54.37 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 108.873 -177.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -64.76 119.38 10.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -173.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.1 mt -92.42 -42.38 9.79 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 159.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -148.65 154.69 40.03 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.803 0.841 . . . . 0.0 109.886 171.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.11 148.98 22.56 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.415 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -140.88 137.09 32.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 171.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -124.26 146.87 48.49 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -130.09 3.83 4.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.751 0.82 . . . . 0.0 110.992 -176.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -136.49 153.13 51.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.667 0.787 . . . . 0.0 111.054 -174.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.37 -0.49 12.54 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.285 2.234 . . . . 0.0 113.076 -173.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 p -65.6 -38.21 88.8 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.992 -1.068 . . . . 0.0 111.578 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -143.41 64.69 14.1 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.031 0.832 . . . . 0.0 110.467 -177.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -86.78 -1.02 8.11 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.851 2.367 . . . . 0.0 113.083 -175.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.6 m -133.71 137.51 45.31 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.399 1.08 . . . . 0.0 109.224 -169.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -50.64 -44.41 25.4 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 125.048 1.339 . . . . 0.0 113.47 -169.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -57.98 -45.77 86.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.667 0.667 . . . . 0.0 111.135 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.08 -35.98 64.28 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -60.26 -52.56 64.77 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.178 0.591 . . . . 0.0 109.887 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -57.78 -39.73 78.18 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.595 0.758 . . . . 0.0 110.647 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.65 83.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.098 0.559 . . . . 0.0 110.184 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -64.08 -38.66 91.87 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.44 0.696 . . . . 0.0 110.952 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -60.21 -46.56 89.33 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.631 1.972 . . . . 0.0 110.711 174.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.89 -46.29 91.2 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.026 0.83 . . . . 0.0 110.228 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -47.04 77.65 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.503 0.721 . . . . 0.0 110.752 177.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.81 -51.34 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.035 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -60.66 -46.56 89.87 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.892 0.769 . . . . 0.0 110.272 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -55.37 -43.71 75.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.455 1.102 . . . . 0.0 111.736 178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -75.24 -49.73 18.4 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.999 0.52 . . . . 0.0 110.417 -177.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.1 p -68.57 -30.66 69.47 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.731 -0.605 . . . . 0.0 111.887 -172.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -58.22 -23.85 57.16 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.291 -0.881 . . . . 0.0 111.541 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.41 20.95 17.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.487 1.515 . . . . 0.0 110.339 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 84.4 m -125.29 156.6 38.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 108.949 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -84.62 35.1 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.526 1.53 . . . . 0.0 112.679 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.7 m 65.86 -176.91 0.19 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.249 1.82 . . . . 0.0 113.446 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.312 9.6 pt-20 56.31 -42.11 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 131.536 3.934 . . . . 0.0 117.006 -176.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.7 tt -158.02 151.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 120.245 1.384 . . . . 0.0 110.024 -173.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.81 177.74 9.27 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.434 1.893 . . . . 0.0 108.291 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 tt -140.57 125.61 18.43 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 170.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -77.29 -65.88 0.9 Allowed 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -169.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -142.72 4.04 1.49 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.195 1.798 . . . . 0.0 110.915 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.48 -40.95 0.67 Allowed Glycine 0 CA--C 1.525 0.666 0 C-N-CA 125.773 1.654 . . . . 0.0 109.319 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.84 126.91 29.96 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 170.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.1 m -80.22 146.21 31.84 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.4 p -136.71 121.15 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.42 142.4 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.865 -2.642 . . . . 0.0 103.865 168.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -152.43 167.11 29.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.555 0.693 . . . . 0.0 110.892 176.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -154.78 154.26 32.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -172.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -140.01 130.93 26.1 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -149.92 148.21 28.83 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.179 0.591 . . . . 0.0 109.633 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.4 mp 53.28 -89.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.772 2.029 . . . . 0.0 111.147 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -147.6 33.97 0.86 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.772 2.029 . . . . 0.0 108.903 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.3 tp -140.19 150.65 44.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.69 1.596 . . . . 0.0 110.47 -168.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -126.28 144.76 50.68 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -129.61 143.83 51.0 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.284 1.834 . . . . 0.0 107.764 -173.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -149.52 150.35 32.17 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.459 1.027 . . . . 0.0 111.774 -172.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.5 t -139.58 119.66 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -104.53 138.01 31.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 106.187 -1.782 . . . . 0.0 106.187 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.68 176.73 31.54 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-O 122.369 0.983 . . . . 0.0 112.666 177.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.8 m -61.49 157.05 17.95 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.619 1.568 . . . . 0.0 112.328 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 m -72.92 34.38 0.07 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.01 2.124 . . . . 0.0 112.083 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -70.28 176.98 3.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.429 1.492 . . . . 0.0 111.355 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -63.96 -12.91 41.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.07 1.748 . . . . 0.0 112.963 -177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -144.75 161.61 38.8 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.85 0.86 . . . . 0.0 110.581 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -9.23 8.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.559 2.744 . . . . 0.0 110.202 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.23 -31.93 69.51 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.903 1.281 . . . . 0.0 110.609 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -64.56 -35.59 81.48 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.396 0.998 . . . . 0.0 111.96 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.96 -43.14 72.15 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 30.8 tpp -64.88 -33.88 77.05 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.131 0.572 . . . . 0.0 111.174 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.42 -50.41 67.7 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.749 1.22 . . . . 0.0 109.949 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.9 t -60.17 -44.97 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.336 0.516 . . . . 0.0 110.097 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.93 -53.01 63.17 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.339 0.656 . . . . 0.0 110.091 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -60.39 -43.54 96.56 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.884 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.15 -45.9 92.76 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.257 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.0 tp -64.37 -49.35 71.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.999 0.818 . . . . 0.0 110.406 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -59.46 -46.62 88.27 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.47 0.176 . . . . 0.0 110.847 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -69.23 -38.44 78.51 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 118.813 -0.613 . . . . 0.0 111.03 -176.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.1 m -59.5 -50.96 71.9 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.799 0.84 . . . . 0.0 110.803 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt -54.91 -45.97 74.82 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -61.33 -37.38 83.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.791 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -68.82 -55.51 10.95 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 120.091 1.314 . . . . 0.0 109.432 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -74.16 -36.97 64.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.699 -169.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.6 tp -82.93 -28.76 29.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.887 0.767 . . . . 0.0 111.918 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 40.11 54.01 2.74 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.771 1.628 . . . . 0.0 112.831 -171.052 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -135.16 -179.51 5.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.89 2.076 . . . . 0.0 106.914 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -1.49 12.39 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 177.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.313 11.9 m 48.47 38.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.161 2.184 . . . . 0.0 111.87 -174.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -66.21 171.26 4.87 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.259 1.023 . . . . 0.0 110.023 171.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -60.54 -37.74 82.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -62.04 -45.47 93.41 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.495 1.043 . . . . 0.0 110.003 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.78 -33.1 73.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.512 0.325 . . . . 0.0 111.125 -174.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.326 0.0 OUTLIER -81.16 -32.93 33.42 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.518 -1.364 . . . . 0.0 110.95 176.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.3 tp -60.95 -36.74 80.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.293 0.951 . . . . 0.0 111.22 169.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.12 -7.96 59.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.319 -0.863 . . . . 0.0 112.845 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.82 30.79 5.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.457 1.103 . . . . 0.0 112.702 175.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -41.07 -46.08 2.84 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.167 1.387 . . . . 0.0 112.667 174.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.98 -40.55 96.65 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.056 0.843 . . . . 0.0 111.451 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.8 -42.79 98.4 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.58 -49.56 75.97 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.414 1.086 . . . . 0.0 110.543 173.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -56.09 -47.25 78.36 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 118.693 0.679 . . . . 0.0 109.734 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.5 mt -67.74 -36.98 81.53 Favored 'General case' 0 CA--C 1.527 0.072 0 CA-C-O 118.859 -0.591 . . . . 0.0 111.121 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.55 -45.37 93.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.076 0.853 . . . . 0.0 110.054 175.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.07 -49.4 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 118.673 0.67 . . . . 0.0 109.348 176.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.49 -23.29 62.64 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.415 1.086 . . . . 0.0 113.05 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -97.21 -19.59 18.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.655 1.182 . . . . 0.0 111.809 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 61.2 mt -88.79 -40.86 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.394 0.997 . . . . 0.0 109.474 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.2 m -140.32 145.27 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.97 1.308 . . . . 0.0 109.539 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -144.61 134.32 23.57 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.625 1.57 . . . . 0.0 107.302 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.44 28.67 51.48 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.369 -0.684 . . . . 0.0 113.07 -176.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.09 15.98 81.12 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 118.23 1.015 . . . . 0.0 113.678 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 59.4 t -131.6 140.07 49.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 119.326 1.563 . . . . 0.0 107.517 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.0 pt -62.46 146.12 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.975 -0.453 . . . . 0.0 110.522 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.55 -5.39 3.29 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.739 0.815 . . . . 0.0 112.392 172.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -153.57 154.55 34.47 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 169.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.2 m -140.1 24.46 2.34 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.654 1.182 . . . . 0.0 110.856 -171.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -140.15 122.61 9.96 Favored Pre-proline 0 C--O 1.234 0.251 0 C-N-CA 124.476 1.11 . . . . 0.0 108.201 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.92 -30.45 16.89 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.379 2.053 . . . . 0.0 111.819 -169.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.28 -41.24 73.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 121.473 -0.767 . . . . 0.0 109.11 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.97 -39.48 87.22 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.676 0.671 . . . . 0.0 109.905 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.96 -55.59 11.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.57 -39.19 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.37 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -60.36 -46.55 89.56 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.513 1.051 . . . . 0.0 110.743 176.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -72.68 -31.79 65.31 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.862 1.21 . . . . 0.0 111.754 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.92 -41.49 89.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 119.393 0.997 . . . . 0.0 109.432 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.38 -35.78 71.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.033 0.533 . . . . 0.0 111.85 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.32 -25.97 59.88 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.889 0.875 . . . . 0.0 112.397 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.295 171.327 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 . . . . . 0 C--O 1.235 0.335 0 CA-C-O 120.741 0.305 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 m -60.41 -34.28 73.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.505 1.122 . . . . 0.0 110.414 176.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.45 142.38 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -96.16 -41.7 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.412 1.085 . . . . 0.0 109.593 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.15 168.33 20.95 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.401 0.546 . . . . 0.0 111.642 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.9 137.08 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 127.292 2.237 . . . . 0.0 104.986 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 mt -133.89 151.26 51.45 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 62.6 mt -136.83 120.49 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 103.691 -2.707 . . . . 0.0 103.691 169.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.6 mt -123.68 148.84 46.14 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.733 0.813 . . . . 0.0 108.818 -169.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.68 172.25 3.6 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.685 0.755 . . . . 0.0 109.439 170.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.89 7.07 0.41 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.389 1.876 . . . . 0.0 114.054 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -131.66 11.0 4.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.873 1.669 . . . . 0.0 110.839 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.46 4.37 83.36 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.271 -0.893 . . . . 0.0 113.538 176.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -69.72 130.51 42.53 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.024 1.412 . . . . 0.0 110.197 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -67.14 105.5 1.71 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.397 1.079 . . . . 0.0 110.595 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.9 mt -81.55 -43.96 17.99 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 166.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -147.08 152.91 39.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.037 0.935 . . . . 0.0 109.741 174.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.11 149.98 19.88 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.045 0.938 . . . . 0.0 108.875 168.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -143.18 139.9 30.53 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 125.564 1.546 . . . . 0.0 106.941 169.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -127.27 150.11 49.71 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -129.29 -2.84 4.99 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -171.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -138.04 173.11 11.98 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.141 0.882 . . . . 0.0 110.921 -176.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -72.09 61.99 0.45 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.799 2.439 . . . . 0.0 109.044 174.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.6 m -154.31 91.99 1.47 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.638 -3.097 . . . . 0.0 102.638 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 55.43 60.9 8.91 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.377 1.471 . . . . 0.0 111.042 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -79.98 -2.73 12.3 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.5 2.133 . . . . 0.0 113.731 -175.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -136.22 141.88 44.01 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.379 0.99 . . . . 0.0 109.853 -169.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.2 t -43.92 -52.05 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 126.529 1.932 . . . . 0.0 113.326 -169.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -58.92 -42.72 90.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.527 0.603 . . . . 0.0 111.206 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.69 -32.39 63.91 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.678 0.391 . . . . 0.0 110.175 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -63.93 -48.83 74.98 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 123.232 0.613 . . . . 0.0 109.848 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -58.48 -35.74 72.66 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 118.754 0.706 . . . . 0.0 111.39 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.74 -48.74 70.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -63.3 -37.44 87.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.866 0.466 . . . . 0.0 111.189 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.7 -45.2 83.71 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.88 1.672 . . . . 0.0 111.004 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -60.8 -44.55 96.71 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.939 -0.475 . . . . 0.0 109.902 173.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.36 -46.51 79.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.251 0.62 . . . . 0.0 111.355 174.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.5 mm -57.59 -55.7 19.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 C-N-CA 124.468 1.107 . . . . 0.0 108.312 -178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -64.92 -41.04 95.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.982 0.356 . . . . 0.0 110.539 -175.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -59.42 -41.04 88.61 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.866 -0.521 . . . . 0.0 111.804 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -81.3 -45.71 15.8 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.22 0.463 . . . . 0.0 110.346 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.6 p -70.44 -26.89 63.86 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -169.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -74.2 -3.82 32.18 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.248 1.385 . . . . 0.0 112.091 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.3 mtt-85 -113.58 16.39 18.71 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 110.075 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -131.89 157.64 43.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.108 1.363 . . . . 0.0 108.599 -169.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.01 85.55 4.23 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.477 1.111 . . . . 0.0 109.67 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.406 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 5.5 m -47.07 136.85 8.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.051 1.74 . . . . 0.0 115.509 -169.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.06 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.454 1 C-N-CA 132.906 4.482 . . . . 0.0 107.433 173.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.29 156.82 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.561 1.544 . . . . 0.0 108.485 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.36 171.02 18.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.752 2.021 . . . . 0.0 108.721 174.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.8 tp -133.45 114.31 13.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 mp -114.24 98.82 7.17 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -174.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 57.72 14.33 2.39 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.224 1.81 . . . . 0.0 114.193 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.43 -31.2 2.9 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.683 1.611 . . . . 0.0 111.768 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.7 mt -83.28 129.94 35.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.433 1.116 . . . . 0.0 109.208 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -74.76 141.66 44.39 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 171.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 97.5 t -137.54 131.51 44.06 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.093 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.5 m -118.38 144.75 25.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 169.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.406 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 31.2 p90 -162.18 164.3 27.9 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 111.803 -170.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -150.04 175.01 12.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.024 0.93 . . . . 0.0 108.594 169.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.3 p -139.61 145.35 38.43 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -145.69 137.9 25.52 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 11.8 mt 64.77 -82.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.21 1.804 . . . . 0.0 110.896 170.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -152.9 28.8 0.52 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.392 1.877 . . . . 0.0 108.934 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.6 tp -139.4 146.3 39.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 125.984 1.714 . . . . 0.0 109.428 -168.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -126.07 145.97 50.11 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.142 1.377 . . . . 0.0 107.482 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -136.21 138.07 41.5 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 -170.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -145.85 149.3 34.03 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.875 0.87 . . . . 0.0 111.359 -170.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.8 t -138.15 138.62 43.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 169.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.08 139.25 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -172.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -156.81 177.7 33.6 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-O 122.118 0.843 . . . . 0.0 112.594 -173.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.4 m -59.54 162.24 5.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.678 1.591 . . . . 0.0 112.452 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -71.84 27.46 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.698 1.999 . . . . 0.0 112.207 171.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -71.78 173.46 8.17 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.384 1.073 . . . . 0.0 112.142 -169.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.38 -7.59 38.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.74 1.616 . . . . 0.0 113.328 -172.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -141.8 159.87 41.33 Favored 'General case' 0 C--N 1.339 0.126 0 CA-C-N 119.061 0.846 . . . . 0.0 110.36 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.49 -6.57 10.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.322 2.249 . . . . 0.0 110.317 173.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -36.36 71.81 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.961 1.304 . . . . 0.0 111.099 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -65.86 -33.95 77.02 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.871 0.76 . . . . 0.0 111.675 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 34.3 mt -73.53 -42.48 61.69 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.0 mmt -56.64 -40.17 74.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.011 0.524 . . . . 0.0 110.06 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.89 -49.33 73.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.546 0.738 . . . . 0.0 109.887 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.0 t -60.14 -45.53 95.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 118.118 0.417 . . . . 0.0 110.166 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.5 tp -60.02 -49.29 78.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 122.903 0.481 . . . . 0.0 110.366 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.26 -42.02 96.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.846 -0.597 . . . . 0.0 110.594 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.2 m -60.11 -48.51 81.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.896 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 44.8 tp -64.86 -46.47 81.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.566 1.075 . . . . 0.0 111.155 -176.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.29 -46.88 88.31 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 122.999 0.52 . . . . 0.0 110.916 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.26 -26.4 52.45 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.33 -0.856 . . . . 0.0 111.641 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.7 m -62.98 -50.29 71.37 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.134 0.879 . . . . 0.0 110.313 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.2 mt -52.0 -47.75 64.79 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -58.92 -25.57 63.57 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.706 -1.14 . . . . 0.0 113.909 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -85.58 -53.5 5.13 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 121.041 1.746 . . . . 0.0 110.951 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -75.18 -38.11 60.98 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.598 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 tp -82.0 -39.1 24.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.959 0.504 . . . . 0.0 110.062 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.272 26.0 ptt-85 39.05 53.02 2.08 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.162 1.785 . . . . 0.0 112.237 -178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -131.96 -169.82 2.28 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 128.215 2.606 . . . . 0.0 105.703 169.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -72.48 7.3 1.9 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.296 16.8 m 44.76 41.05 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.914 2.086 . . . . 0.0 112.164 -171.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -73.5 160.31 31.89 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.262 1.025 . . . . 0.0 109.485 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 33.4 pttt -60.37 -32.49 71.35 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -172.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -37.44 75.05 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.761 0.424 . . . . 0.0 110.258 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.74 -34.83 72.29 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.319 173.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -60.42 -45.38 93.82 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.962 -1.086 . . . . 0.0 110.441 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.79 -39.34 73.92 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.66 0.784 . . . . 0.0 111.094 175.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -63.66 -25.61 68.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.09 27.38 5.4 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 118.787 0.721 . . . . 0.0 112.689 -171.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -40.7 -48.82 3.02 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 125.074 1.349 . . . . 0.0 112.247 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.41 -40.29 96.8 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.819 0.736 . . . . 0.0 111.722 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.17 -44.33 97.87 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.79 -50.0 75.57 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.464 1.105 . . . . 0.0 110.322 175.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -54.91 -48.78 72.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.667 0.667 . . . . 0.0 109.897 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.91 -37.52 84.51 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.181 0.592 . . . . 0.0 111.194 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.81 90.38 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.655 0.661 . . . . 0.0 109.867 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.3 t -57.31 -44.38 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.564 0.62 . . . . 0.0 109.529 175.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -71.66 1.48 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.133 0.973 . . . . 0.0 113.433 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -118.28 -12.03 9.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.666 1.586 . . . . 0.0 111.34 172.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.6 mt -88.06 -40.57 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 24.0 t -133.69 145.61 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.319 1.048 . . . . 0.0 110.513 -169.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -144.87 130.7 19.16 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 125.846 1.658 . . . . 0.0 106.898 168.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.78 29.61 55.0 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 119.398 -0.668 . . . . 0.0 113.868 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.65 16.22 80.43 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.288 1.044 . . . . 0.0 113.289 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.5 t -127.91 138.45 54.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.9 pt -66.2 147.06 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.6 pp -128.03 -11.69 5.3 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.246 1.018 . . . . 0.0 111.692 177.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -147.79 157.22 43.43 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 169.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 7.3 m -141.83 26.64 1.88 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.996 0.918 . . . . 0.0 110.862 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -141.97 128.76 11.24 Favored Pre-proline 0 C--O 1.236 0.346 0 C-N-CA 124.084 0.953 . . . . 0.0 108.501 177.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.48 -38.55 8.24 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.846 2.364 . . . . 0.0 113.67 -172.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.281 0.0 OUTLIER -76.36 -26.98 56.25 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.873 -1.142 . . . . 0.0 110.162 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 -66.18 -44.33 84.32 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.537 1.062 . . . . 0.0 109.618 169.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.4 t -54.88 -51.64 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 118.926 0.785 . . . . 0.0 109.541 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.39 -38.22 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.05 0.841 . . . . 0.0 110.693 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -62.92 -38.85 92.62 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.674 1.125 . . . . 0.0 110.947 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 25.2 mtt-85 -64.01 -46.73 83.21 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.925 0.784 . . . . 0.0 109.998 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.7 t -58.34 -41.41 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.95 -33.95 74.54 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.553 0.741 . . . . 0.0 111.994 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 29.9 mt -72.34 -32.15 66.25 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.042 0.937 . . . . 0.0 111.983 177.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.332 -0.842 . . . . 0.0 109.998 176.647 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 C--O 1.235 0.294 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 m -63.15 -38.59 91.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.312 1.845 . . . . 0.0 110.637 175.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.7 m -141.66 153.39 19.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 124.644 1.178 . . . . 0.0 108.036 175.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -111.75 -28.7 7.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 117.206 -1.378 . . . . 0.0 110.688 174.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.14 166.66 25.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.14 1.336 . . . . 0.0 112.38 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.4 mt -136.21 136.67 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mt -135.41 154.02 51.6 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.048 0.939 . . . . 0.0 108.682 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.9 mt -138.83 123.87 21.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 169.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.5 mt -129.15 149.07 51.11 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -171.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.432 ' C ' ' H ' ' A' ' 22' ' ' ASP . 15.8 t0 -65.61 172.68 3.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.548 170.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -74.4 30.05 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.906 2.083 . . . . 0.0 111.878 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 20' ' ' ASP . 36.8 t70 -147.98 7.66 0.83 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.278 2.231 . . . . 0.0 110.79 176.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.54 10.06 86.51 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 121.001 -1.062 . . . . 0.0 113.105 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -72.35 129.68 38.97 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 118.751 1.276 . . . . 0.0 109.949 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.74 106.84 0.73 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 125.315 1.446 . . . . 0.0 109.996 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.6 -44.41 8.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 166.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -147.29 151.5 36.72 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.754 0.822 . . . . 0.0 109.531 172.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.89 145.12 15.27 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 169.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -146.98 146.85 30.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.939 1.295 . . . . 0.0 108.181 174.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -135.23 149.64 49.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.259 1.424 . . . . 0.0 107.704 -174.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -132.62 0.34 3.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.674 1.19 . . . . 0.0 111.612 -174.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -131.9 160.63 35.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.845 0.858 . . . . 0.0 108.796 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.26 6.12 3.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.595 1.958 . . . . 0.0 112.897 -170.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 p -61.99 -48.63 79.47 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.823 1.249 . . . . 0.0 110.735 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -144.84 73.48 14.97 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.233 1.013 . . . . 0.0 109.212 -175.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -85.01 -2.51 9.59 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.459 2.106 . . . . 0.0 113.956 -173.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -137.65 140.73 41.01 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.368 0.985 . . . . 0.0 110.054 -169.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.23 -43.95 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.14 1.376 . . . . 0.0 113.229 -169.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -59.26 -38.29 79.71 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 117.799 0.272 . . . . 0.0 111.428 -176.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -85.84 -32.51 21.69 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.012 0.369 . . . . 0.0 110.236 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.6 -51.88 66.71 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 123.269 0.628 . . . . 0.0 110.201 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -60.41 -31.67 70.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.546 -0.721 . . . . 0.0 111.348 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.81 -48.13 67.13 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -61.51 -36.55 80.84 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.031 0.532 . . . . 0.0 111.055 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -66.83 -44.08 82.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.602 1.561 . . . . 0.0 111.311 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -60.71 -44.11 97.0 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.677 -0.639 . . . . 0.0 110.014 172.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.66 -45.95 81.37 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.599 0.76 . . . . 0.0 111.224 174.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.62 -53.35 45.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 C-N-CA 124.259 1.024 . . . . 0.0 108.474 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -62.5 -46.05 90.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.477 0.58 . . . . 0.0 110.362 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 -56.09 -42.45 76.76 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.997 0.919 . . . . 0.0 111.915 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -78.69 -47.83 16.17 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.171 0.589 . . . . 0.0 110.156 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.0 p -66.88 -30.38 70.52 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.54 -0.725 . . . . 0.0 111.851 -175.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -59.71 -20.72 58.24 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.363 -0.835 . . . . 0.0 112.23 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -108.58 17.63 21.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.842 1.657 . . . . 0.0 110.433 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 56.4 m -121.61 163.33 19.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.89 1.276 . . . . 0.0 108.942 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -95.63 25.5 4.52 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.076 1.75 . . . . 0.0 113.333 -169.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.429 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.0 m 73.82 176.88 0.24 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.315 1.846 . . . . 0.0 113.227 172.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.319 10.5 pt-20 56.33 -43.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 131.072 3.749 . . . . 0.0 116.354 -173.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -148.11 155.85 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 120.303 1.411 . . . . 0.0 109.766 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.85 167.03 27.74 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.248 2.219 . . . . 0.0 108.133 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 tp -135.08 116.07 14.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mp -117.35 97.29 5.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -172.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 57.45 15.92 2.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.225 1.81 . . . . 0.0 114.082 171.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.99 -28.36 3.91 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.7 1.619 . . . . 0.0 111.971 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.3 mt -82.26 128.27 34.02 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.474 1.137 . . . . 0.0 109.178 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.8 m -75.88 138.24 40.94 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 172.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.9 t -136.9 133.48 48.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.8 m -118.87 146.85 22.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 169.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.429 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -158.16 162.77 37.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.166 0.508 . . . . 0.0 110.981 -175.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -148.16 174.76 11.64 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.236 1.014 . . . . 0.0 108.418 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -139.76 146.58 39.69 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 169.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.1 m -142.45 137.66 30.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.89 0.876 . . . . 0.0 108.691 177.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.8 mt 63.17 -76.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 127.26 2.224 . . . . 0.0 110.805 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -156.37 31.35 0.33 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.719 1.608 . . . . 0.0 109.999 176.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.1 tp -140.17 149.46 43.0 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.293 1.437 . . . . 0.0 109.421 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -124.19 149.97 45.75 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.537 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -139.77 142.91 36.72 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.369 1.468 . . . . 0.0 107.862 -172.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -147.44 152.43 38.08 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.666 0.786 . . . . 0.0 111.189 -170.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.7 t -138.9 140.14 39.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 169.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.47 140.56 48.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.54 -179.86 34.64 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-O 122.664 1.147 . . . . 0.0 112.074 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.4 m -64.69 164.74 11.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.735 1.614 . . . . 0.0 112.557 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.2 p -74.02 37.93 0.1 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.997 2.119 . . . . 0.0 111.377 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -68.03 169.4 10.15 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.577 1.151 . . . . 0.0 110.819 -175.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.48 -4.18 21.51 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.651 1.18 . . . . 0.0 113.558 -174.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -149.35 172.63 14.6 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.368 1.467 . . . . 0.0 108.786 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.38 -1.98 3.51 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.055 2.542 . . . . 0.0 110.256 -176.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -64.49 -30.9 71.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.737 1.215 . . . . 0.0 110.51 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -35.06 79.28 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.263 0.938 . . . . 0.0 111.497 172.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -69.37 -46.41 67.02 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.1 mmt -55.25 -41.35 72.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.39 174.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.13 -50.08 71.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.005 0.922 . . . . 0.0 110.038 -179.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.33 -43.77 97.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.217 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.2 tp -60.89 -48.9 79.69 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 118.482 0.583 . . . . 0.0 110.486 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -63.67 -44.11 94.73 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.351 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 92.5 m -60.35 -47.06 87.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.147 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.6 tp -64.86 -49.12 71.78 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 119.057 0.844 . . . . 0.0 110.787 -177.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.59 -42.36 98.75 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.175 0.443 . . . . 0.0 110.927 -177.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -73.14 -36.63 66.71 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.49 -0.756 . . . . 0.0 111.173 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 20.8 m -63.76 -43.34 96.71 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.971 0.805 . . . . 0.0 110.85 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.8 mt -53.7 -50.35 66.07 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.9 m -57.18 -38.69 73.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.368 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.6 -49.54 66.0 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.35 -0.833 . . . . 0.0 111.54 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 4.2 ptp -69.99 -34.98 74.03 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.379 0.99 . . . . 0.0 111.211 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.43 -43.14 64.26 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.868 0.467 . . . . 0.0 111.024 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 51.96 27.21 4.2 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.065 1.346 . . . . 0.0 112.437 -169.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -156.59 -175.62 5.53 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.177 2.191 . . . . 0.0 107.676 177.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -46.85 123.45 5.18 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.992 1.317 . . . . 0.0 110.233 174.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 17.2 m -84.91 51.05 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.993 1.317 . . . . 0.0 108.974 171.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.11 178.21 7.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.364 1.066 . . . . 0.0 111.652 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -47.73 -54.28 12.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.65 1.18 . . . . 0.0 112.718 -175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -65.04 -41.37 95.28 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.313 0.506 . . . . 0.0 109.733 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.83 76.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.151 0.581 . . . . 0.0 111.97 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -69.54 -49.56 53.21 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 123.984 0.914 . . . . 0.0 110.253 171.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.6 tp -56.33 -37.41 69.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.808 0.843 . . . . 0.0 111.263 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -81.98 -3.31 54.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.543 0.737 . . . . 0.0 112.339 -178.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -132.91 22.43 4.19 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.786 1.235 . . . . 0.0 112.209 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -43.4 21.36 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.207 1.003 . . . . 0.0 111.724 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.26 -42.88 92.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.853 0.752 . . . . 0.0 111.466 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.14 -41.49 99.7 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 177.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.16 -48.92 78.79 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.559 1.144 . . . . 0.0 110.672 173.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.09 -45.52 83.29 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 118.808 0.731 . . . . 0.0 109.683 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.68 -35.38 78.73 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.164 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.25 89.7 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 119.081 0.855 . . . . 0.0 110.145 175.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.1 t -57.52 -47.74 84.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.11 -21.73 63.99 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.487 1.115 . . . . 0.0 113.158 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -97.64 -22.8 16.28 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.277 1.031 . . . . 0.0 111.562 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 67.4 mt -83.13 -45.29 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.3 0.954 . . . . 0.0 108.976 177.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 m -139.89 153.26 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.413 1.085 . . . . 0.0 110.684 -171.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -149.32 140.69 23.24 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.347 1.459 . . . . 0.0 107.85 169.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.45 28.01 54.84 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.464 -0.631 . . . . 0.0 113.463 177.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.68 17.79 79.57 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.194 0.997 . . . . 0.0 113.41 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 56.4 t -132.41 142.08 43.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 119.07 1.435 . . . . 0.0 107.383 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.6 pt -65.18 151.21 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 O-C-N 121.976 -0.452 . . . . 0.0 110.284 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 pp -134.32 -10.58 2.52 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.867 0.867 . . . . 0.0 111.939 170.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -149.01 155.61 41.04 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.3 m -140.31 23.56 2.35 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.241 1.417 . . . . 0.0 110.878 -170.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -140.46 125.1 10.91 Favored Pre-proline 0 C--O 1.236 0.356 0 C-N-CA 124.208 1.003 . . . . 0.0 108.865 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.88 -34.31 5.4 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.322 2.015 . . . . 0.0 113.924 -169.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.308 2.3 pp0? -76.11 -27.3 57.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.945 -1.097 . . . . 0.0 110.304 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -67.54 -45.29 76.1 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.357 0.98 . . . . 0.0 109.501 169.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.5 t -54.21 -56.52 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.58 -33.47 63.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.237 0.926 . . . . 0.0 110.656 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -50.31 74.24 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.334 0.97 . . . . 0.0 109.824 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -69.07 -30.92 69.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.996 1.271 . . . . 0.0 112.462 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.65 -43.92 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.661 1.119 . . . . 0.0 109.742 171.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.66 -31.08 66.43 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.095 0.558 . . . . 0.0 111.884 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.6 tp -68.76 -33.96 74.78 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 125.696 1.598 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 63.5 mtt85 . . . . . 0 C--O 1.249 1.052 0 O-C-N 123.383 0.427 . . . . 0.0 110.405 173.547 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.236 0.388 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 p -69.01 -37.52 78.73 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.4 m -139.82 157.56 26.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 174.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -121.94 -28.83 4.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.589 1.155 . . . . 0.0 111.058 -172.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -158.04 163.94 37.21 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.704 1.138 . . . . 0.0 110.689 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.8 mt -135.06 135.16 52.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.2 mt -133.91 149.31 51.29 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.92 116.72 14.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 103.592 -2.744 . . . . 0.0 103.592 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.8 mt -124.44 145.38 49.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.08 169.03 7.45 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.304 0.574 . . . . 0.0 110.305 169.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -13.77 1.93 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -178.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -112.99 5.9 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.649 1.18 . . . . 0.0 110.844 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.99 7.27 59.85 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 125.021 1.296 . . . . 0.0 112.666 173.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.44 131.69 45.16 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 119.252 1.526 . . . . 0.0 109.738 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -58.21 127.49 32.37 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.9 mt -107.84 -40.16 5.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 161.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -148.08 153.11 38.46 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 123.382 0.673 . . . . 0.0 109.713 170.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.5 145.9 19.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.208 1.003 . . . . 0.0 108.449 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.98 139.15 27.3 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.873 1.669 . . . . 0.0 106.77 176.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -128.63 151.02 49.96 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.928 1.291 . . . . 0.0 108.18 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -134.04 22.3 3.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.698 1.999 . . . . 0.0 108.4 174.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.72 147.98 48.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.652 1.581 . . . . 0.0 111.39 -168.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -96.73 -6.87 35.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.521 1.528 . . . . 0.0 111.953 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.5 m -70.68 -38.22 73.72 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.31 -0.869 . . . . 0.0 109.649 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -136.41 67.59 60.32 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 125.029 1.332 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -87.77 -1.33 7.34 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.768 2.312 . . . . 0.0 113.645 -176.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.8 m -135.23 141.0 45.71 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.065 0.848 . . . . 0.0 110.22 -169.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -46.03 -50.03 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.422 1.889 . . . . 0.0 112.736 -169.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -55.83 -47.29 77.46 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.144 0.429 . . . . 0.0 111.304 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -79.27 -32.42 43.67 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -177.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.34 -50.83 72.04 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 123.439 0.696 . . . . 0.0 110.624 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -62.7 -31.84 72.82 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.972 0.806 . . . . 0.0 111.132 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.95 72.15 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.914 -0.491 . . . . 0.0 110.007 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.91 -42.96 99.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.24 0.616 . . . . 0.0 110.223 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.14 -42.7 91.28 Favored 'General case' 0 C--N 1.334 -0.092 0 C-N-CA 126.562 1.945 . . . . 0.0 112.063 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -59.72 -43.32 94.22 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 118.996 0.816 . . . . 0.0 109.594 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -45.01 91.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 118.055 -0.974 . . . . 0.0 111.627 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.25 -55.55 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -58.61 -45.51 89.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.897 0.879 . . . . 0.0 110.702 -174.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -54.57 -45.52 73.54 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.267 1.027 . . . . 0.0 111.453 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -70.83 -49.58 44.82 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 119.065 -0.493 . . . . 0.0 110.348 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 37.2 p -67.62 -31.3 71.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.54 1.064 . . . . 0.0 111.398 -173.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -59.27 -23.89 62.77 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.606 0.762 . . . . 0.0 111.304 172.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -120.71 36.06 4.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.315 1.446 . . . . 0.0 109.797 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.9 m -127.98 158.17 38.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.822 1.649 . . . . 0.0 106.581 170.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.75 -59.61 3.41 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.741 -0.6 . . . . 0.0 111.037 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m 177.57 -169.47 0.08 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.73 3.212 . . . . 0.0 107.286 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.322 10.4 pt-20 60.8 -47.91 0.11 Allowed 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 131.203 3.801 . . . . 0.0 117.196 169.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -158.41 152.72 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 121.024 1.738 . . . . 0.0 110.915 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.63 173.89 11.13 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.57 1.948 . . . . 0.0 108.775 170.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.3 tp -137.09 115.05 11.46 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.077 -2.194 . . . . 0.0 105.077 -176.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -75.62 -72.82 0.29 Allowed 'General case' 0 N--CA 1.457 -0.094 0 O-C-N 123.264 0.353 . . . . 0.0 110.138 -172.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -144.97 6.39 1.17 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.343 1.857 . . . . 0.0 110.881 -175.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 149.02 -40.27 0.9 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 126.086 1.803 . . . . 0.0 108.98 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.2 mt -68.61 142.93 55.0 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.9 m -107.86 146.44 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.9 p -139.67 118.77 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.3 m -86.41 150.05 3.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 106.282 -1.748 . . . . 0.0 106.282 169.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -153.73 166.09 33.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.582 0.706 . . . . 0.0 111.39 175.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.501 ' HE3' ' CE1' ' A' ' 98' ' ' PHE . 37.6 tttp -152.17 156.93 40.77 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.896 1.679 . . . . 0.0 106.758 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -136.13 135.53 39.33 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m -142.07 142.74 32.86 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.626 0.77 . . . . 0.0 109.382 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 mp 53.71 -85.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.156 2.182 . . . . 0.0 111.898 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -150.14 31.93 0.68 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.41 1.884 . . . . 0.0 108.806 -176.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.7 tp -140.38 145.21 36.81 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.494 1.918 . . . . 0.0 108.571 -169.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -127.79 140.25 52.16 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.679 1.192 . . . . 0.0 107.803 -179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -123.68 141.48 51.98 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.675 1.59 . . . . 0.0 107.47 -176.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -146.9 152.31 38.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 119.013 0.824 . . . . 0.0 110.524 -175.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 63.5 t -141.06 122.61 14.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 105.801 -1.925 . . . . 0.0 105.801 169.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -99.19 142.11 15.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.64 174.82 38.21 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-O 121.892 0.718 . . . . 0.0 112.4 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.31 176.5 3.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.148 1.379 . . . . 0.0 109.74 173.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.0 p -152.34 72.9 1.01 Allowed 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.377 -0.827 . . . . 0.0 109.383 172.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -54.94 -43.98 73.88 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.553 0.741 . . . . 0.0 111.037 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -145.17 -12.58 0.54 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.781 1.232 . . . . 0.0 112.173 172.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -156.52 175.69 13.7 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.565 1.146 . . . . 0.0 109.89 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.56 4.36 4.64 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.872 2.469 . . . . 0.0 110.585 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.2 -32.35 73.73 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 120.869 -1.144 . . . . 0.0 110.663 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -32.46 72.31 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.999 0.818 . . . . 0.0 111.682 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.89 -50.05 68.07 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 172.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.3 mmt -55.64 -41.24 73.28 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.538 0.335 . . . . 0.0 110.295 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.14 75.72 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.587 0.755 . . . . 0.0 110.287 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.91 -44.78 98.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 119.027 0.83 . . . . 0.0 110.07 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.82 -50.76 72.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.344 0.52 . . . . 0.0 110.616 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -64.24 -40.29 95.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 119.581 -0.247 . . . . 0.0 110.484 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.07 -45.56 93.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.474 0.71 . . . . 0.0 109.574 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 tp -65.08 -49.63 69.3 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.786 0.721 . . . . 0.0 111.114 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.501 ' CE1' ' HE3' ' A' ' 70' ' ' LYS . 68.5 t80 -60.93 -43.81 98.11 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.376 0.608 . . . . 0.0 110.88 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.59 -28.81 37.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.322 -0.861 . . . . 0.0 111.969 -174.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 23.3 p -66.72 -45.88 77.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 119.905 1.23 . . . . 0.0 110.01 172.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.1 mt -51.13 -49.43 60.81 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 m -58.85 -32.32 69.33 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.159 -0.924 . . . . 0.0 113.262 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -76.36 -50.64 13.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 120.603 1.547 . . . . 0.0 110.659 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -79.78 -32.21 40.88 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 119.357 -0.937 . . . . 0.0 112.95 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.3 tp -82.37 -32.54 29.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 118.058 0.39 . . . . 0.0 111.9 -170.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 46.36 47.79 13.69 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.083 1.353 . . . . 0.0 112.275 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -138.08 174.97 10.0 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.928 2.091 . . . . 0.0 105.903 169.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -72.25 15.32 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -178.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.28 24.0 m 44.06 41.7 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 127.148 2.179 . . . . 0.0 111.734 -173.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.6 170.57 15.51 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.205 1.002 . . . . 0.0 110.841 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -53.96 -42.09 68.52 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.476 0.71 . . . . 0.0 112.798 -176.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.7 tpp85 -66.57 -42.17 87.44 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-O 118.887 -0.578 . . . . 0.0 110.073 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.38 -39.03 93.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.899 0.772 . . . . 0.0 110.388 -179.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.03 -50.97 71.6 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.614 0.766 . . . . 0.0 110.089 171.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.9 tp -58.0 -37.88 75.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.51 0.724 . . . . 0.0 111.684 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -67.61 -21.88 65.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.838 0.855 . . . . 0.0 112.864 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.43 24.6 4.8 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.259 0.936 . . . . 0.0 113.12 -171.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -45.33 3.44 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.197 1.399 . . . . 0.0 112.351 177.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -66.24 -38.2 87.33 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.427 1.012 . . . . 0.0 112.275 -178.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.84 -40.55 93.68 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 175.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.27 -48.91 77.67 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.139 0.976 . . . . 0.0 110.242 170.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -57.74 -46.56 84.29 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.9 mt -65.62 -38.88 90.68 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.472 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.97 -48.73 79.07 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-N 119.039 0.836 . . . . 0.0 109.631 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.0 t -56.72 -46.78 83.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.6 . . . . 0.0 109.458 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -68.71 -0.53 5.42 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.273 1.429 . . . . 0.0 113.56 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -120.64 -15.65 8.41 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.534 1.533 . . . . 0.0 111.34 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 65.7 mt -82.36 -37.04 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.306 1.043 . . . . 0.0 109.009 169.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.07 153.51 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.27 0.941 . . . . 0.0 110.384 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -150.54 136.94 18.76 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.307 1.443 . . . . 0.0 107.248 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.75 29.74 50.41 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.488 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.46 18.34 79.34 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-N 118.067 0.933 . . . . 0.0 113.7 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 41.4 t -126.47 133.03 69.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 174.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.5 pt -60.2 156.87 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.74 0.781 . . . . 0.0 111.422 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.0 mt -120.23 -22.24 6.66 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.291 1.836 . . . . 0.0 110.271 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -154.85 160.61 41.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.036 0.835 . . . . 0.0 109.973 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 m -135.52 14.04 3.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.998 1.319 . . . . 0.0 112.205 -169.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.79 123.29 10.61 Favored Pre-proline 0 N--CA 1.465 0.277 0 C-N-CA 123.72 0.808 . . . . 0.0 110.09 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.7 -44.63 13.12 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.728 2.286 . . . . 0.0 112.941 -170.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pp0? -73.92 -26.94 60.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 119.292 -0.963 . . . . 0.0 111.07 -175.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.05 -35.2 74.08 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.547 1.521 . . . . 0.0 110.539 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.7 -43.27 87.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 119.575 1.079 . . . . 0.0 109.24 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.43 -39.47 84.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.844 1.202 . . . . 0.0 111.028 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -61.04 -45.5 94.51 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.904 1.229 . . . . 0.0 110.155 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -59.04 -47.79 83.96 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.855 -0.528 . . . . 0.0 110.017 177.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 62.6 t -59.5 -41.93 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.496 0.718 . . . . 0.0 109.912 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.05 -34.86 77.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.186 0.595 . . . . 0.0 111.782 -178.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.33 -32.32 58.63 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.944 0.898 . . . . 0.0 111.929 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.838 178.834 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.234 0.253 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 m -54.06 -40.34 67.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.532 1.133 . . . . 0.0 111.267 -176.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.3 m -140.5 164.29 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.413 1.085 . . . . 0.0 108.692 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -122.8 -28.98 4.06 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 125.001 1.32 . . . . 0.0 110.191 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.75 166.9 27.9 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.753 1.16 . . . . 0.0 111.867 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -136.61 136.31 48.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -132.44 149.29 52.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 61.8 mt -139.1 120.39 15.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 104.175 -2.528 . . . . 0.0 104.175 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.8 mt -127.76 149.24 50.33 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.38 171.19 4.09 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -17.06 62.42 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.795 0.838 . . . . 0.0 112.354 173.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.5 -9.48 59.4 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.298 1.039 . . . . 0.0 112.095 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.44 86.01 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 0.0 112.274 -171.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -74.56 143.22 44.57 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.461 1.131 . . . . 0.0 109.941 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -59.61 133.02 55.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.626 0.648 . . . . 0.0 110.21 177.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt -106.31 -38.6 6.18 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 151.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.63 154.33 36.2 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.792 0.837 . . . . 0.0 110.632 172.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 146.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.433 1.093 . . . . 0.0 108.585 169.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.99 144.26 30.94 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 125.699 1.6 . . . . 0.0 107.505 171.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -128.81 150.47 50.3 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.554 1.542 . . . . 0.0 107.513 176.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -135.14 -0.86 2.7 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.816 0.846 . . . . 0.0 111.984 -174.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -135.02 160.2 39.07 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.885 0.766 . . . . 0.0 110.125 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -72.06 3.39 4.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.71 2.004 . . . . 0.0 113.194 -170.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -62.45 -49.04 77.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.414 1.085 . . . . 0.0 110.752 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -142.86 69.3 19.09 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.222 1.009 . . . . 0.0 109.537 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -85.74 -2.37 9.0 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.698 2.265 . . . . 0.0 113.627 -173.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.1 m -135.9 141.92 44.63 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 119.278 0.945 . . . . 0.0 109.617 -169.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.4 t -44.52 -52.82 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 126.469 1.908 . . . . 0.0 113.137 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -60.32 -45.0 94.96 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.624 0.647 . . . . 0.0 111.014 -175.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -69.98 -34.12 72.95 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -62.66 -51.5 67.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 118.625 -0.702 . . . . 0.0 109.857 174.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.97 -38.03 75.28 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.275 0.943 . . . . 0.0 111.496 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.17 -50.09 73.23 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.213 0.605 . . . . 0.0 109.609 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.52 -38.65 91.95 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.454 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.0 -45.09 96.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 126.444 1.898 . . . . 0.0 111.473 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.23 -40.03 93.52 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 121.546 -0.721 . . . . 0.0 110.035 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.03 -49.55 75.47 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.669 -0.681 . . . . 0.0 111.062 171.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -54.85 -50.71 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 124.703 1.201 . . . . 0.0 108.71 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -61.17 -49.32 77.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.67 0.388 . . . . 0.0 110.318 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -57.4 -49.37 76.41 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.893 0.477 . . . . 0.0 111.1 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm -60.46 -52.44 65.21 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.0 p -71.87 -32.16 67.19 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.903 -0.498 . . . . 0.0 111.885 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -63.12 -15.12 55.69 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.515 -0.74 . . . . 0.0 111.443 171.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -120.85 25.52 9.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.185 1.794 . . . . 0.0 109.837 -176.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 94.8 m -131.42 158.1 41.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.169 1.788 . . . . 0.0 107.711 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.18 -42.11 99.32 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 118.442 -0.79 . . . . 0.0 112.879 -170.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m 139.8 -177.71 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.805 1 C-N-CA 132.427 4.291 . . . . 0.0 108.878 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.324 10.2 pt-20 59.07 -44.03 0.07 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 131.226 3.81 . . . . 0.0 117.307 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.0 tt -150.23 155.48 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 120.61 1.55 . . . . 0.0 109.932 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.79 166.06 30.58 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.034 2.134 . . . . 0.0 108.541 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.66 115.71 14.96 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 104.331 -2.47 . . . . 0.0 104.331 171.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 pp -147.28 138.42 23.8 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.896 0.878 . . . . 0.0 109.565 -172.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 52.42 27.04 4.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.002 1.321 . . . . 0.0 112.196 -177.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.82 4.3 90.39 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.585 1.088 . . . . 0.0 113.525 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -108.74 138.85 44.39 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.453 1.501 . . . . 0.0 108.751 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 51.2 m -83.15 136.99 34.24 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 72.3 t -135.07 138.41 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 32.0 m -120.48 147.43 24.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -158.73 162.37 37.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.93 0.395 . . . . 0.0 110.958 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -149.71 175.83 11.23 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.457 1.103 . . . . 0.0 108.514 170.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.4 p -142.37 146.65 35.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 169.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -145.44 149.03 33.97 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.318 1.047 . . . . 0.0 109.115 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 mp 50.36 -90.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.151 1.781 . . . . 0.0 110.989 -172.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -148.55 36.71 0.81 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.411 1.884 . . . . 0.0 108.99 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 64.3 tp -134.14 145.21 49.06 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 127.24 2.216 . . . . 0.0 107.889 -169.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -125.02 144.98 50.12 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -133.96 141.21 47.2 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.126 1.37 . . . . 0.0 107.515 -173.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -145.46 147.52 32.28 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.958 0.903 . . . . 0.0 110.271 -171.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.0 t -134.77 137.32 51.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 105.329 -2.1 . . . . 0.0 105.329 169.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -127.98 133.86 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 105.117 -2.179 . . . . 0.0 105.117 -172.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -154.79 176.35 32.55 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 122.311 0.95 . . . . 0.0 112.695 -178.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.3 m -63.71 129.97 42.3 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 113.798 -1.201 . . . . 0.0 109.225 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -67.23 125.18 25.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -153.79 -175.57 5.43 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.003 0.921 . . . . 0.0 109.442 -169.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.8 -14.16 30.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.629 1.571 . . . . 0.0 112.789 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -144.47 159.24 43.08 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.264 1.026 . . . . 0.0 110.061 174.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.43 -4.16 7.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.056 2.542 . . . . 0.0 109.944 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.2 -31.73 71.49 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.941 1.296 . . . . 0.0 110.722 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.1 ptt? -64.92 -34.34 78.16 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.24 0.927 . . . . 0.0 111.664 173.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -70.11 -46.67 64.35 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.0 mmt -55.61 -40.58 72.29 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.281 174.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.13 74.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.066 0.946 . . . . 0.0 109.896 -178.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.5 t -61.94 -44.12 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-O 118.946 -0.55 . . . . 0.0 110.074 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.67 -46.89 87.8 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.907 0.776 . . . . 0.0 110.665 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -63.8 -45.17 90.88 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 119.04 -0.505 . . . . 0.0 110.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.9 m -60.45 -44.65 95.63 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.154 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.14 -55.72 29.1 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.615 0.643 . . . . 0.0 110.171 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -62.71 -43.95 97.47 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.899 0.38 . . . . 0.0 110.632 -173.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -71.7 -37.02 70.73 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.707 -0.621 . . . . 0.0 111.166 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 t -56.59 -52.38 65.06 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.159 0.984 . . . . 0.0 109.691 174.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 77.1 mt -53.77 -48.44 69.75 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.8 m -56.43 -35.58 68.0 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.613 -0.708 . . . . 0.0 112.332 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -74.59 -47.71 30.89 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.571 1.078 . . . . 0.0 111.233 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 10.2 ptp -69.35 -38.95 78.37 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -169.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.327 2.7 pp -97.26 -5.24 37.24 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -174.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 49.82 30.3 3.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -147.07 179.03 7.9 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.814 1.646 . . . . 0.0 106.879 169.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.87 137.1 57.88 Favored 'General case' 0 C--O 1.23 0.078 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.5 m -76.31 45.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.318 1.847 . . . . 0.0 111.604 -174.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.3 170.15 7.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.84 0.856 . . . . 0.0 111.16 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -54.79 -42.28 71.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.829 -0.545 . . . . 0.0 112.117 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -65.81 -42.49 90.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.485 0.584 . . . . 0.0 109.64 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.23 81.56 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.286 0.494 . . . . 0.0 110.355 -177.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.298 0.0 OUTLIER -74.84 -28.59 60.75 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.073 0.851 . . . . 0.0 111.587 -179.255 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.8 tp -60.89 -39.65 90.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.768 1.167 . . . . 0.0 110.774 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.26 -14.1 62.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.519 0.727 . . . . 0.0 112.179 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -127.75 24.9 6.06 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.267 1.027 . . . . 0.0 111.64 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.29 -45.76 24.43 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.405 1.082 . . . . 0.0 112.29 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.79 -43.53 96.06 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.05 0.841 . . . . 0.0 110.775 -178.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.48 -43.18 99.41 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.7 tp -56.47 -52.43 64.74 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.969 1.308 . . . . 0.0 109.993 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -59.11 -44.84 92.0 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.181 0.446 . . . . 0.0 109.879 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.09 -37.59 86.16 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.804 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.19 91.91 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.981 0.81 . . . . 0.0 110.463 175.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 48.6 t -54.68 -49.04 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -71.6 2.7 4.79 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.016 1.326 . . . . 0.0 113.631 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -119.09 -17.04 9.06 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.533 1.533 . . . . 0.0 111.305 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.33 -46.3 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.25 154.36 30.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.406 1.082 . . . . 0.0 110.8 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -147.3 137.86 23.43 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 125.926 1.69 . . . . 0.0 107.257 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.89 25.48 52.9 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.43 18.09 76.6 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-N 118.149 0.974 . . . . 0.0 113.363 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.6 t -131.8 139.47 50.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 119.343 1.572 . . . . 0.0 107.043 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 18.4 pt -64.07 150.08 10.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 O-C-N 122.147 -0.346 . . . . 0.0 110.667 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -132.79 -14.51 2.77 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.2 1.0 . . . . 0.0 111.928 174.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -149.54 154.07 38.16 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 169.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.4 m -137.12 26.66 2.94 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.561 1.144 . . . . 0.0 110.906 -169.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -143.07 125.74 8.9 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.42 -33.9 10.34 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.295 1.996 . . . . 0.0 111.643 -169.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.86 -40.36 79.38 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -178.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -68.27 -39.84 82.05 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.542 0.61 . . . . 0.0 109.795 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.9 t -55.58 -52.9 42.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 118.741 0.701 . . . . 0.0 109.47 173.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.59 -40.48 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.499 1.045 . . . . 0.0 110.11 -179.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -63.02 -40.21 97.08 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.032 0.833 . . . . 0.0 111.044 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -68.57 -42.32 78.48 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.506 -0.746 . . . . 0.0 110.281 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 53.2 t -57.51 -43.22 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 118.595 0.634 . . . . 0.0 109.409 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.1 -33.58 73.74 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.409 0.684 . . . . 0.0 111.914 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 31.3 mt -72.26 -31.3 65.65 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.197 0.999 . . . . 0.0 112.137 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.967 176.539 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 . . . . . 0 C--O 1.235 0.322 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 34.3 p -80.66 -44.02 19.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 p -122.27 121.57 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.745 1.218 . . . . 0.0 108.037 -169.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -75.06 -42.16 57.51 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 123.655 0.782 . . . . 0.0 109.362 174.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.28 165.72 23.92 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.233 0.47 . . . . 0.0 111.196 -171.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.27 131.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.9 mt -130.41 148.16 52.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mt -138.54 118.84 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 173.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.7 mt -122.68 143.04 50.04 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -175.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.41 167.79 13.96 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 169.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -57.29 -22.03 38.94 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.67 -25.5 20.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.727 1.149 . . . . 0.0 111.305 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.81 6.97 5.79 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 126.046 1.784 . . . . 0.0 112.557 173.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.29 129.48 40.02 Favored 'General case' 0 C--N 1.338 0.075 0 CA-C-N 119.088 1.444 . . . . 0.0 109.789 -178.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -66.32 94.59 0.27 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 109.288 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -50.87 61.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 168.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -148.78 153.09 37.66 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -156.87 147.55 21.58 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 169.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.445 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.7 OUTLIER -143.51 147.89 35.17 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.077 1.351 . . . . 0.0 107.504 169.913 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -137.73 143.76 41.36 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.91 1.684 . . . . 0.0 106.482 -175.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.06 -2.99 5.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.262 1.025 . . . . 0.0 112.621 -173.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -131.04 162.71 29.21 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.842 0.746 . . . . 0.0 109.08 -177.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -71.72 7.27 1.56 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.833 2.053 . . . . 0.0 112.505 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 p -61.68 -52.7 63.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.46 1.504 . . . . 0.0 110.207 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -144.29 70.75 16.12 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 124.64 1.176 . . . . 0.0 109.039 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.02 -1.62 9.43 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 122.667 2.245 . . . . 0.0 113.69 -172.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 m -136.49 139.38 42.26 Favored 'General case' 0 C--N 1.34 0.174 0 C-N-CA 123.971 0.908 . . . . 0.0 109.773 -169.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.5 t -46.42 -49.1 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 126.066 1.746 . . . . 0.0 113.025 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -58.47 -43.31 88.85 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.722 0.692 . . . . 0.0 111.406 -176.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.14 -32.18 58.98 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.856 0.298 . . . . 0.0 110.299 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -62.48 -48.73 78.32 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.252 0.621 . . . . 0.0 110.231 175.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -59.79 -35.71 75.23 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.983 0.811 . . . . 0.0 111.178 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.05 -44.86 75.43 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.02 0.528 . . . . 0.0 109.961 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.77 -38.35 90.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.077 0.551 . . . . 0.0 111.005 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.75 -41.25 96.06 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.701 1.6 . . . . 0.0 110.872 177.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.3 mmtt -60.34 -45.9 91.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.708 -0.62 . . . . 0.0 109.769 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.2 -48.12 77.04 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.431 0.692 . . . . 0.0 111.176 174.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mm -56.68 -54.07 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 C-N-CA 124.41 1.084 . . . . 0.0 108.546 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -60.28 -48.99 79.37 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.174 0.59 . . . . 0.0 109.926 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -60.37 -39.66 88.02 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.517 1.127 . . . . 0.0 112.692 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt -73.37 -50.04 24.04 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 121.645 -0.659 . . . . 0.0 109.344 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.409 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 33.1 p -70.39 -31.87 69.28 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -69.11 -5.37 21.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.938 0.79 . . . . 0.0 112.527 173.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtp-105 -126.78 28.27 5.89 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.388 1.875 . . . . 0.0 109.353 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 99.4 m -134.47 158.17 44.59 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.913 1.685 . . . . 0.0 108.048 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 29.05 0.46 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.542 1.537 . . . . 0.0 113.324 -169.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m 67.81 -179.53 0.22 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.016 1.726 . . . . 0.0 113.319 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.7 pt-20 56.62 -43.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 131.362 3.865 . . . . 0.0 117.006 -176.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.6 tt -154.89 155.25 6.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 120.21 1.368 . . . . 0.0 109.772 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.5 172.69 14.08 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.487 1.915 . . . . 0.0 108.389 172.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -134.43 121.24 20.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 103.64 -2.726 . . . . 0.0 103.64 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.2 mt -78.14 -69.08 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.062 -168.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -142.53 7.9 1.74 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.548 1.939 . . . . 0.0 110.281 -176.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.82 -43.73 0.78 Allowed Glycine 0 CA--C 1.525 0.662 0 C-N-CA 126.241 1.877 . . . . 0.0 108.703 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.6 mt -68.49 129.31 39.56 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.826 0.85 . . . . 0.0 109.889 174.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 85.3 m -78.76 148.13 33.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.4 p -140.13 130.9 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 171.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -101.3 144.8 12.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 25.7 p90 -160.11 162.16 33.97 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.004 0.366 . . . . 0.0 111.61 -175.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -154.46 -179.85 8.34 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 169.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -135.26 149.24 49.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 123.885 0.874 . . . . 0.0 109.094 170.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -146.44 142.2 27.9 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.3 mt 61.68 -84.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 126.703 2.001 . . . . 0.0 110.85 174.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -148.99 25.77 0.91 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.236 2.614 . . . . 0.0 109.737 -176.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.27 150.48 51.49 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.194 2.198 . . . . 0.0 109.581 -169.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -130.35 143.62 50.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.53 1.532 . . . . 0.0 107.582 170.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -135.89 137.42 41.41 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.801 1.24 . . . . 0.0 107.669 -170.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -144.08 144.6 31.69 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 -171.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 62.0 t -135.74 121.79 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.39 134.29 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 -173.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -149.42 172.39 29.44 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 122.005 0.781 . . . . 0.0 113.325 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.5 m -64.72 164.16 12.65 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.466 -1.367 . . . . 0.0 109.277 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.9 m -129.01 29.12 5.24 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.915 0.886 . . . . 0.0 110.752 -169.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 38.8 p90 -61.69 -34.56 75.96 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.873 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -160.72 -33.31 0.05 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.484 0.584 . . . . 0.0 112.418 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.24 171.77 14.45 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.693 0.797 . . . . 0.0 111.487 -170.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.1 -2.5 2.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.888 2.475 . . . . 0.0 110.69 -174.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -66.16 -33.61 76.17 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 124.266 1.026 . . . . 0.0 110.714 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -32.49 74.08 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.643 0.656 . . . . 0.0 111.253 173.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.8 mt -70.25 -43.64 70.11 Favored 'General case' 0 C--O 1.23 0.067 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.8 mmt -55.82 -40.89 73.41 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.064 173.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -47.87 78.7 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.121 0.568 . . . . 0.0 110.468 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.25 -46.92 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.696 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 60.4 tp -60.07 -45.65 92.2 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.575 0.625 . . . . 0.0 110.514 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -63.24 -47.08 83.98 Favored 'General case' 0 C--N 1.338 0.094 0 CA-C-O 119.146 -0.455 . . . . 0.0 110.237 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.7 m -61.55 -44.66 96.63 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.192 0.451 . . . . 0.0 110.389 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.6 tp -60.5 -53.57 55.88 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.887 0.875 . . . . 0.0 110.791 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.82 -41.41 97.86 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.684 0.278 . . . . 0.0 110.908 -177.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -75.03 -31.81 61.42 Favored 'General case' 0 N--CA 1.456 -0.141 0 O-C-N 121.51 -0.744 . . . . 0.0 111.294 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -62.67 -47.75 82.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.916 0.78 . . . . 0.0 110.023 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.5 mt -51.7 -51.42 56.16 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -34.12 69.77 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -71.67 -41.55 68.56 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.645 1.111 . . . . 0.0 111.437 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -97.85 3.36 49.85 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -171.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.8 tp -141.32 58.19 1.52 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.208 1.803 . . . . 0.0 107.902 -172.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -69.54 49.83 0.09 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.49 2.316 . . . . 0.0 112.9 -171.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.7 pttt -137.55 -67.86 0.48 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.848 1.259 . . . . 0.0 109.318 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -159.45 149.19 18.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 174.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.5 m -90.91 50.42 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-O 121.809 0.814 . . . . 0.0 109.71 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.95 167.9 11.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.872 1.269 . . . . 0.0 111.275 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -49.15 -54.66 15.33 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.155 1.382 . . . . 0.0 112.743 -171.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -62.04 -42.64 99.4 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 122.462 0.305 . . . . 0.0 110.499 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.49 -38.58 87.56 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.388 0.54 . . . . 0.0 110.582 -177.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.79 -45.37 92.96 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 121.421 -0.799 . . . . 0.0 110.207 174.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 68.6 tp -57.28 -38.25 73.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.288 0.635 . . . . 0.0 111.322 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -71.5 -16.99 62.37 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.92 23.54 4.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.404 1.002 . . . . 0.0 112.685 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -37.41 -50.09 1.05 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.334 1.854 . . . . 0.0 113.179 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -62.12 -40.3 95.44 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.539 1.063 . . . . 0.0 111.377 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.76 -45.86 94.86 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 177.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.75 -51.08 71.48 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.021 0.928 . . . . 0.0 110.747 175.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -54.43 -48.39 71.73 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 109.6 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.78 -33.31 66.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.434 -175.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.84 -44.48 96.02 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 119.37 0.987 . . . . 0.0 109.843 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -58.04 -45.77 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.448 0.567 . . . . 0.0 109.482 175.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -3.02 6.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.687 1.195 . . . . 0.0 113.506 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -115.29 -17.97 11.19 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.222 1.409 . . . . 0.0 111.745 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 55.6 mt -86.1 -30.35 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.265 1.026 . . . . 0.0 109.179 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.6 t -139.97 147.59 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 125.245 1.418 . . . . 0.0 107.938 -170.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -143.31 130.84 21.16 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.86 1.264 . . . . 0.0 107.646 170.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.9 52.1 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.538 175.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.01 16.45 79.5 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-N 118.225 1.012 . . . . 0.0 113.684 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 57.4 t -127.87 142.32 44.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 44.2 pt -54.53 142.9 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.526 0.679 . . . . 0.0 110.562 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.53 -42.3 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.996 1.718 . . . . 0.0 108.317 -175.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -144.86 156.42 44.0 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.135 0.974 . . . . 0.0 108.716 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -135.29 24.92 3.51 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.152 1.381 . . . . 0.0 110.49 -172.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -141.84 118.1 7.18 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 124.377 1.071 . . . . 0.0 108.87 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 -32.57 11.59 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.701 2.267 . . . . 0.0 111.79 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.19 -40.44 86.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -69.63 -36.55 76.24 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.816 0.735 . . . . 0.0 110.298 177.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.7 t -56.78 -55.68 18.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 123.236 0.614 . . . . 0.0 109.396 175.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 34.1 m -67.18 -30.14 48.32 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 CA-C-N 119.2 0.909 . . . . 0.0 111.287 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.54 -51.88 67.56 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.017 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -62.53 -40.77 97.83 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.73 1.15 . . . . 0.0 110.844 178.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 t -56.66 -45.93 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.104 0.411 . . . . 0.0 110.384 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -79.62 -26.52 41.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.026 0.83 . . . . 0.0 111.452 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 63.7 tp -71.88 -22.29 61.53 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.396 1.879 . . . . 0.0 112.1 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.0 ptt-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.083 1.353 . . . . 0.0 113.167 178.632 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 . . . . . 0 C--O 1.237 0.436 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.7 p -66.85 -26.83 67.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 109.993 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -135.6 141.1 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -100.06 -27.34 13.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 117.682 -1.152 . . . . 0.0 109.723 173.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.27 166.09 28.19 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.56 1.073 . . . . 0.0 111.916 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.9 mt -134.01 137.19 52.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -134.11 150.79 51.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 61.0 mt -137.69 114.35 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 102.925 -2.991 . . . . 0.0 102.925 169.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 46.2 mt -117.29 147.78 42.27 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 122.238 1.018 . . . . 0.0 110.164 -169.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -68.85 172.55 6.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 113.449 -1.705 . . . . 0.0 107.928 169.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -78.08 35.6 0.21 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.05 2.14 . . . . 0.0 111.126 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -149.09 8.1 0.73 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.696 2.398 . . . . 0.0 110.838 178.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.11 47.91 69.29 Favored Glycine 0 C--N 1.342 0.872 0 O-C-N 120.883 -1.136 . . . . 0.0 110.767 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -123.97 126.7 46.77 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 118.013 0.906 . . . . 0.0 108.846 -178.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -60.61 107.98 0.76 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.78 0.832 . . . . 0.0 110.888 -177.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -74.12 -41.59 61.37 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 155.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -141.14 149.1 41.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.081 1.352 . . . . 0.0 108.208 171.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.55 144.02 16.55 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.461 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -148.23 147.63 29.59 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.013 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -135.49 149.11 49.44 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.624 1.57 . . . . 0.0 106.978 -176.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -133.54 -1.36 3.14 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.974 0.91 . . . . 0.0 111.92 -174.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -135.05 159.4 41.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.927 0.785 . . . . 0.0 110.036 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -73.53 2.28 8.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.021 2.129 . . . . 0.0 113.043 -169.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -59.64 -47.54 85.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.337 1.055 . . . . 0.0 110.724 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -144.87 79.38 12.11 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.53 1.132 . . . . 0.0 108.261 -177.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -92.67 -0.6 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.864 2.376 . . . . 0.0 113.504 -174.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 m -134.31 138.05 44.67 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.131 0.972 . . . . 0.0 109.814 -169.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.24 -44.85 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.257 1.423 . . . . 0.0 113.532 -169.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -61.14 -44.62 97.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 117.959 0.345 . . . . 0.0 110.646 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -78.9 -32.51 45.78 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.66 -50.1 73.86 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.355 0.525 . . . . 0.0 110.455 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -62.39 -33.46 74.8 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.064 -1.023 . . . . 0.0 111.153 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.5 73.69 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.946 -0.471 . . . . 0.0 109.866 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.17 -37.96 81.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.657 0.783 . . . . 0.0 110.699 175.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -63.33 -42.81 98.99 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.793 1.637 . . . . 0.0 110.997 176.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -61.36 -44.65 96.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.164 0.893 . . . . 0.0 110.447 172.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.407 HD22 ' CD2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -58.15 -45.48 87.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.077 0.551 . . . . 0.0 111.198 177.28 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.1 mm -58.28 -53.91 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.377 1.071 . . . . 0.0 108.394 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.19 -43.74 95.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.73 0.412 . . . . 0.0 110.813 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -56.03 -48.24 76.33 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.347 0.659 . . . . 0.0 110.641 174.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -61.67 -50.66 71.6 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 118.107 0.412 . . . . 0.0 109.925 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.9 p -71.74 -31.16 66.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.925 0.784 . . . . 0.0 111.801 -171.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -62.88 -16.53 59.16 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.718 0.69 . . . . 0.0 111.467 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -117.95 25.0 10.66 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.093 1.757 . . . . 0.0 109.814 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.8 m -133.52 158.54 42.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.312 1.845 . . . . 0.0 107.554 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.97 -48.15 80.09 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 118.443 -0.789 . . . . 0.0 112.371 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.0 m 153.91 -175.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 131.768 4.027 . . . . 0.0 108.192 -177.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.2 pt-20 59.62 -43.4 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 131.486 3.914 . . . . 0.0 117.427 173.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.9 tt -155.3 153.01 8.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 120.729 1.604 . . . . 0.0 110.024 -176.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.06 172.24 14.57 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 126.038 1.735 . . . . 0.0 108.429 170.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.5 tp -140.8 116.18 10.05 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.407 ' CD2' HD22 ' A' ' 47' ' ' ASN . 8.7 mp -84.65 -155.85 0.22 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.447 1.499 . . . . 0.0 108.912 178.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.61 15.63 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.187 2.595 . . . . 0.0 114.205 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.55 -10.54 1.28 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 126.004 1.764 . . . . 0.0 112.1 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.2 mt -112.88 119.8 39.24 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.358 1.079 . . . . 0.0 109.319 -171.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.2 m -72.69 144.34 47.74 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 171.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 3.9 p -136.97 134.34 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.45 137.99 45.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -154.69 166.63 32.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 120.595 0.235 . . . . 0.0 111.027 -169.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -152.05 175.91 12.06 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 123.763 0.825 . . . . 0.0 108.913 169.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 m -141.15 133.4 28.07 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -144.46 145.75 32.07 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.48 0.712 . . . . 0.0 109.957 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.8 mp 49.31 -86.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.971 2.108 . . . . 0.0 111.614 -171.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -149.06 28.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.961 2.104 . . . . 0.0 108.978 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.5 tp -132.96 144.66 50.27 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.529 1.532 . . . . 0.0 109.198 -169.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -125.78 137.44 53.79 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -129.13 141.36 51.21 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.646 1.178 . . . . 0.0 108.214 -171.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -147.23 148.54 31.58 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.809 0.844 . . . . 0.0 110.866 -169.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.5 t -135.84 125.71 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 170.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.3 mp -114.78 137.67 47.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 -177.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.33 178.41 35.48 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-O 122.519 1.066 . . . . 0.0 113.294 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.9 m -65.27 133.84 52.33 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 112.972 -1.614 . . . . 0.0 107.798 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 m -78.56 48.17 0.77 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.836 1.254 . . . . 0.0 110.831 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -72.55 64.97 0.64 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.041 2.537 . . . . 0.0 110.617 -174.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 54.53 14.19 0.79 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.393 2.277 . . . . 0.0 113.754 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.76 160.67 25.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 126.833 2.053 . . . . 0.0 107.48 -171.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.98 -5.64 1.89 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.062 2.145 . . . . 0.0 110.047 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -61.25 -34.42 75.12 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.447 1.099 . . . . 0.0 110.671 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.38 -33.91 76.94 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.022 0.828 . . . . 0.0 112.054 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.5 mt -71.77 -41.91 67.82 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.1 mtp -60.29 -37.06 79.35 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.714 173.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.01 63.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.713 0.805 . . . . 0.0 109.851 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -61.56 -44.91 99.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 118.237 0.471 . . . . 0.0 109.869 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.89 -51.44 69.6 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 123.261 0.624 . . . . 0.0 109.744 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -62.16 -45.57 92.81 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.631 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 85.8 m -60.99 -42.81 99.14 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.083 0.856 . . . . 0.0 111.073 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.4 tp -68.56 -48.18 64.93 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.92 0.782 . . . . 0.0 110.794 -177.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -64.15 -40.29 95.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.941 -0.475 . . . . 0.0 110.824 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -77.21 -33.8 56.19 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.239 -0.913 . . . . 0.0 111.624 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.5 p -64.86 -42.26 95.01 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.729 1.15 . . . . 0.0 109.85 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.5 mt -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -61.13 -13.59 18.64 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -94.9 -37.75 11.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 120.611 1.55 . . . . 0.0 112.111 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -97.92 -0.95 43.95 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.0 tp -134.99 52.64 2.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.981 1.712 . . . . 0.0 109.206 -171.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -68.73 61.9 0.1 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.77 2.028 . . . . 0.0 112.627 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.402 ' HG3' ' H ' ' A' ' 108' ' ' ASN . 15.0 ptmt -138.29 -66.58 0.49 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.319 1.848 . . . . 0.0 106.952 169.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.402 ' H ' ' HG3' ' A' ' 107' ' ' LYS . 5.8 m-20 -163.6 150.04 11.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 129.102 2.961 . . . . 0.0 103.354 169.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.61 40.89 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 118.829 0.74 . . . . 0.0 109.962 171.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -86.2 172.74 10.29 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.242 1.017 . . . . 0.0 111.912 -173.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -54.81 -53.59 53.26 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 124.525 1.13 . . . . 0.0 112.51 -172.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.0 mmt180 -65.0 -39.23 93.15 Favored 'General case' 0 N--CA 1.463 0.202 0 O-C-N 121.979 -0.451 . . . . 0.0 110.19 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.53 -39.87 94.57 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.194 0.452 . . . . 0.0 111.228 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.303 0.0 OUTLIER -76.43 -29.78 57.14 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.98 -1.075 . . . . 0.0 110.864 178.39 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.6 tp -60.78 -36.14 78.25 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.726 0.694 . . . . 0.0 111.188 169.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -65.86 -25.72 67.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.679 -0.638 . . . . 0.0 112.711 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -131.01 31.9 4.39 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.823 0.849 . . . . 0.0 112.607 -173.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -39.18 -48.53 1.76 Allowed 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.816 1.646 . . . . 0.0 112.585 175.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -67.34 -35.45 79.4 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.676 0.671 . . . . 0.0 111.883 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.72 -42.53 99.76 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 172.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.75 -45.94 92.37 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.052 0.941 . . . . 0.0 111.23 173.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -54.99 -47.04 75.15 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.318 0.963 . . . . 0.0 109.788 175.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.3 mt -67.44 -32.8 73.91 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.673 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.59 -45.64 86.1 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.086 0.857 . . . . 0.0 110.151 174.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.33 -41.55 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 118.57 0.623 . . . . 0.0 109.924 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.91 -24.04 63.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.213 1.005 . . . . 0.0 112.574 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -91.85 -41.76 10.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.586 0.63 . . . . 0.0 110.927 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.65 -38.07 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 118.814 0.734 . . . . 0.0 109.481 -177.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.6 t -131.14 144.87 36.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.371 1.068 . . . . 0.0 109.21 -171.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -142.07 126.26 17.47 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 124.869 1.268 . . . . 0.0 107.687 169.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.92 30.29 59.97 Favored Glycine 0 CA--C 1.534 1.222 0 CA-C-O 119.361 -0.688 . . . . 0.0 113.35 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.32 12.21 84.79 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.335 1.067 . . . . 0.0 113.554 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.2 t -120.61 139.83 46.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 177.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.7 pt -56.4 138.82 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.196 0.522 . . . . 0.0 110.066 173.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -127.46 -35.62 2.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.581 1.553 . . . . 0.0 109.409 -171.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -138.93 151.64 47.07 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.5 m -139.24 29.25 2.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.776 1.231 . . . . 0.0 110.822 -169.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -137.98 121.69 11.57 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.31 -34.95 9.12 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.702 2.268 . . . . 0.0 113.634 -171.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -73.55 -38.35 65.27 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.162 0.892 . . . . 0.0 109.835 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -63.2 -37.23 86.41 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.167 0.894 . . . . 0.0 110.409 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.24 -53.52 38.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.686 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 26.3 m -66.5 -33.53 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 121.109 1.777 . . . . 0.0 112.263 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -61.6 -48.72 79.66 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.176 0.898 . . . . 0.0 109.554 177.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -70.21 -34.34 72.79 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.398 -0.814 . . . . 0.0 111.101 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 3.5 t -57.72 -45.77 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 121.394 -0.816 . . . . 0.0 109.633 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.05 -28.0 57.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 122.218 -0.301 . . . . 0.0 111.637 -175.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 54.3 mt -74.89 -26.57 59.75 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.286 1.034 . . . . 0.0 112.13 175.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 C--O 1.249 1.073 0 CA-C-N 119.14 0.882 . . . . 0.0 110.09 171.18 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -149.61 167.65 25.75 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.985 1.314 . . . . 0.0 108.56 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -156.51 163.15 39.74 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.868 1.667 . . . . 0.0 107.834 177.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.6 tp -61.56 -25.22 67.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.416 0.687 . . . . 0.0 112.025 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.8 mt -129.83 47.58 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 125.748 1.619 . . . . 0.0 106.68 178.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -58.29 -24.36 59.28 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.566 -0.708 . . . . 0.0 111.235 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -136.66 150.98 71.79 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 127.532 2.333 . . . . 0.0 105.787 169.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.89 55.67 4.49 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 125.216 3.944 . . . . 0.0 111.462 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 m -70.4 5.74 1.65 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.769 1.628 . . . . 0.0 113.311 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.8 pp -144.45 175.8 9.85 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 126.586 1.954 . . . . 0.0 109.101 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -130.12 143.71 50.94 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.444 1.097 . . . . 0.0 108.694 -173.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.4 p -67.29 -33.46 75.35 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.33 128.05 57.96 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 169.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.6 mtpp -86.5 -30.3 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 118.201 -0.904 . . . . 0.0 108.747 174.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.38 167.56 27.09 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 119.222 0.919 . . . . 0.0 111.564 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.2 mt -136.47 131.42 48.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.8 mt -131.82 148.55 52.56 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mt -140.58 120.28 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 173.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 mt -124.15 147.13 48.2 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.69 169.41 11.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 169.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.7 -18.82 56.5 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.18 -23.03 18.71 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.452 1.024 . . . . 0.0 110.865 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.75 7.45 6.13 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.652 1.596 . . . . 0.0 112.435 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -68.01 130.09 41.91 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 119.355 1.578 . . . . 0.0 109.891 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -67.58 94.49 0.42 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.719 1.207 . . . . 0.0 109.838 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.3 mt -71.32 -47.75 54.71 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -147.01 152.44 38.6 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.384 0.674 . . . . 0.0 109.378 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.22 147.04 19.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 169.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.424 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 1.0 OUTLIER -145.41 147.89 32.72 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 169.76 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -136.73 147.23 46.61 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.816 1.646 . . . . 0.0 106.756 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -133.73 8.3 3.85 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.662 1.185 . . . . 0.0 110.929 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -136.12 148.3 48.17 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.725 0.81 . . . . 0.0 111.298 -169.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.84 -9.01 49.01 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.893 1.677 . . . . 0.0 114.002 -172.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 p -62.86 -40.84 98.71 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.093 -1.004 . . . . 0.0 112.136 176.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -141.77 64.96 19.17 Favored Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 118.951 0.796 . . . . 0.0 110.863 -173.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -86.52 -1.32 8.32 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.817 2.345 . . . . 0.0 113.451 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.6 m -134.98 140.21 45.5 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.028 0.931 . . . . 0.0 109.676 -169.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -45.2 -51.06 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 126.353 1.861 . . . . 0.0 113.01 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -59.05 -43.81 91.74 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.481 0.582 . . . . 0.0 111.201 -175.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.45 -33.59 62.96 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -61.38 -48.91 79.08 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.499 0.72 . . . . 0.0 110.15 174.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.36 -35.81 74.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.207 0.912 . . . . 0.0 111.488 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.78 -48.61 73.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -63.45 -38.0 89.45 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.011 0.524 . . . . 0.0 111.123 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.01 -41.63 97.4 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.758 1.623 . . . . 0.0 111.258 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.03 -38.93 79.45 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 121.576 -0.702 . . . . 0.0 110.12 176.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.6 -51.07 68.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.908 -0.568 . . . . 0.0 110.343 169.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.1 mm -53.55 -55.06 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 124.987 1.315 . . . . 0.0 108.001 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -59.41 -48.05 83.13 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.789 0.436 . . . . 0.0 110.898 -175.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -58.65 -45.96 88.2 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.732 -0.605 . . . . 0.0 111.225 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -71.15 -6.1 36.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 117.596 -1.192 . . . . 0.0 113.167 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.7 p -125.11 -37.25 2.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 120.862 1.664 . . . . 0.0 113.479 -169.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -70.17 -0.35 7.67 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 120.321 1.419 . . . . 0.0 112.622 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -123.27 20.58 9.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.769 2.028 . . . . 0.0 110.009 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 98.3 m -138.26 160.06 40.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.083 1.353 . . . . 0.0 109.33 -169.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.21 85.51 4.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.537 1.135 . . . . 0.0 109.627 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 4.0 m -46.8 139.28 5.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.402 1.881 . . . . 0.0 115.779 -170.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 152.02 -37.49 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.321 1 C-N-CA 132.387 4.275 . . . . 0.0 107.521 170.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.31 155.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.462 1.105 . . . . 0.0 109.306 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.0 173.88 13.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.47 1.908 . . . . 0.0 108.324 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.0 tp -139.29 115.6 10.46 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.089 -2.189 . . . . 0.0 105.089 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.79 143.26 29.57 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.859 0.864 . . . . 0.0 109.848 -169.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 50.33 26.1 2.13 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.816 1.246 . . . . 0.0 112.721 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.68 9.98 82.18 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.054 1.312 . . . . 0.0 114.112 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.4 mt -123.81 130.88 53.32 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 126.093 1.757 . . . . 0.0 109.718 -172.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 m -74.49 142.19 44.85 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.88 132.61 34.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -101.61 149.84 6.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 33.5 p90 -154.67 163.83 39.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.575 0.702 . . . . 0.0 111.859 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -150.95 155.98 40.23 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.901 2.08 . . . . 0.0 106.184 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 m -140.06 143.94 36.59 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.4 m -145.16 128.58 16.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.795 0.838 . . . . 0.0 110.589 169.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.3 mt 57.59 -69.27 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 128.089 2.556 . . . . 0.0 114.783 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -146.09 19.84 1.41 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.208 2.203 . . . . 0.0 109.327 -171.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -138.73 147.01 42.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.471 1.508 . . . . 0.0 110.558 -168.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -132.97 141.35 48.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.694 1.598 . . . . 0.0 106.97 169.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -128.35 136.83 51.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.9 1.68 . . . . 0.0 107.038 -172.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -143.14 145.84 33.19 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.116 0.871 . . . . 0.0 110.478 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.8 t -136.74 127.88 41.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.72 136.15 59.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -157.87 -173.72 26.65 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 121.942 0.746 . . . . 0.0 112.394 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -67.84 171.22 6.85 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 113.824 -1.188 . . . . 0.0 110.041 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.3 m -130.21 28.52 4.99 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.465 1.106 . . . . 0.0 110.512 -171.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -59.24 -52.41 65.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.508 0.723 . . . . 0.0 112.324 -169.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -148.62 -12.87 0.34 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -153.28 164.96 37.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.788 1.176 . . . . 0.0 111.615 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.23 -3.58 5.61 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 127.699 2.4 . . . . 0.0 110.243 174.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.43 -32.96 74.8 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.37 1.068 . . . . 0.0 110.976 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.6 ptt? -64.05 -33.66 76.25 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.901 0.773 . . . . 0.0 111.638 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.7 mt -71.25 -45.99 62.0 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 10.1 mmt -54.67 -41.18 69.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.288 0.635 . . . . 0.0 110.433 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.43 -51.05 67.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 118.794 0.724 . . . . 0.0 110.129 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 53.3 t -62.29 -44.27 98.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 118.89 -0.576 . . . . 0.0 110.004 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 63.2 tp -62.09 -45.31 94.09 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.875 0.762 . . . . 0.0 110.781 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.5 t -59.51 -46.05 89.95 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.66 -51.52 66.9 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.604 1.161 . . . . 0.0 111.861 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -64.61 -40.82 96.18 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.183 -0.323 . . . . 0.0 110.65 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -75.15 -38.37 60.98 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.344 -0.848 . . . . 0.0 111.534 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 21.9 p -63.99 -41.33 97.54 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 119.352 0.978 . . . . 0.0 110.686 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.8 mt -53.88 -51.02 64.99 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 169.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.6 m -54.83 -36.53 65.1 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 118.633 -0.698 . . . . 0.0 112.008 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -72.5 -51.34 20.47 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.516 1.053 . . . . 0.0 111.634 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 58.5 mtm -69.16 -41.02 77.83 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.035 0.834 . . . . 0.0 110.298 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.8 mp -74.16 -31.41 62.69 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.775 0.83 . . . . 0.0 110.27 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 42.77 45.93 4.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.466 1.907 . . . . 0.0 111.258 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mmmt -145.9 -176.32 5.09 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 128.667 2.787 . . . . 0.0 106.868 -173.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.4 17.8 2.02 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.678 0.791 . . . . 0.0 111.396 -175.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.315 5.8 m 45.26 39.12 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 126.948 2.099 . . . . 0.0 111.949 -173.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -78.17 174.17 11.46 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.64 1.176 . . . . 0.0 110.897 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -50.66 67.73 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.066 0.946 . . . . 0.0 112.475 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -65.63 -38.71 90.17 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.199 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.84 -39.76 92.94 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.9 0.773 . . . . 0.0 110.624 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.26 -46.08 78.29 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.737 0.699 . . . . 0.0 111.047 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.9 tp -58.15 -38.64 76.99 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.966 0.507 . . . . 0.0 110.946 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -68.46 -16.97 64.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.251 1.02 . . . . 0.0 113.137 176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -132.52 22.51 4.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.295 0.952 . . . . 0.0 112.214 -169.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -45.0 -45.69 10.77 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.133 1.373 . . . . 0.0 111.905 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.34 -42.35 96.31 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.005 0.82 . . . . 0.0 111.371 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.33 -44.29 98.26 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.3 tp -57.46 -51.04 71.05 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.218 1.007 . . . . 0.0 110.709 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -56.21 -47.32 78.63 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.347 0.521 . . . . 0.0 109.773 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.8 mt -69.63 -30.78 68.58 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.043 -0.503 . . . . 0.0 111.781 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.92 -46.4 78.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.131 0.878 . . . . 0.0 109.706 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.6 t -57.87 -40.65 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.449 0.568 . . . . 0.0 109.77 176.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -63.0 -8.35 7.11 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.28 1.432 . . . . 0.0 113.905 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.27 -31.67 5.9 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.686 1.195 . . . . 0.0 111.723 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 72.6 mt -66.27 -41.08 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 109.085 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.5 m -140.38 160.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.327 1.051 . . . . 0.0 109.875 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -148.6 127.57 12.73 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.197 1.399 . . . . 0.0 107.671 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.16 31.53 56.35 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.34 -0.7 . . . . 0.0 113.434 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.6 11.21 85.5 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.2 1.0 . . . . 0.0 113.823 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -117.61 137.27 52.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 pt -55.14 138.03 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.321 0.581 . . . . 0.0 110.33 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -126.11 -39.97 2.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.41 1.484 . . . . 0.0 108.838 -172.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -145.26 150.82 37.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.57 0.623 . . . . 0.0 109.386 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.4 m -135.05 24.63 3.58 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.902 1.281 . . . . 0.0 111.144 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -128.71 118.77 19.97 Favored Pre-proline 0 C--O 1.236 0.375 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.19 -42.57 2.86 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 121.743 1.629 . . . . 0.0 112.255 -169.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.3 pp0? -70.51 -26.06 63.42 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.555 1.07 . . . . 0.0 110.776 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.41 -45.08 70.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.652 1.115 . . . . 0.0 109.975 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 16.6 t -52.6 -48.91 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 79.6 t -60.9 -41.53 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-O 118.201 -0.905 . . . . 0.0 111.014 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -57.62 -46.9 83.54 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.618 1.099 . . . . 0.0 109.448 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -65.14 -40.3 94.24 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.638 -0.664 . . . . 0.0 111.466 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 96.6 t -63.81 -43.55 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 118.811 0.732 . . . . 0.0 109.555 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.93 -35.74 80.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.02 0.528 . . . . 0.0 111.086 -178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.0 mt -76.66 -28.39 55.97 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.706 1.202 . . . . 0.0 112.519 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 . . . . . 0 C--O 1.25 1.086 0 CA-C-N 118.921 0.782 . . . . 0.0 110.187 172.365 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.07 -7.84 19.83 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.47 -9.39 59.45 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.091 0.957 . . . . 0.0 112.473 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.8 tp -141.29 -31.53 0.58 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.365 1.066 . . . . 0.0 111.861 -171.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.1 mt -127.55 52.04 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.9 tp -57.05 -34.03 67.83 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.42 169.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -136.05 152.83 76.22 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 126.632 1.973 . . . . 0.0 106.168 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.61 4.26 3.15 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.082 3.188 . . . . 0.0 113.264 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.3 m -58.96 -20.15 49.74 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.865 1.666 . . . . 0.0 113.205 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.7 tp -64.04 109.35 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 173.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -56.94 139.34 52.12 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.403 1.081 . . . . 0.0 109.989 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.6 p -71.78 -42.5 67.06 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 81.4 t -123.07 118.59 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -83.39 -33.99 25.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.13 175.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.89 167.27 24.97 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.412 1.005 . . . . 0.0 111.255 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -135.4 133.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 mt -132.98 146.77 52.07 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 54.2 mt -136.67 116.31 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.79 147.9 47.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.593 0.711 . . . . 0.0 110.486 -169.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.404 ' C ' ' H ' ' A' ' 22' ' ' ASP . 3.8 t0 -66.35 171.64 4.67 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.882 169.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 21.18 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.857 2.063 . . . . 0.0 114.111 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 20' ' ' ASP . 37.5 t70 -136.45 11.48 3.23 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.469 1.908 . . . . 0.0 110.602 172.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.98 35.51 71.95 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 120.825 -1.172 . . . . 0.0 111.296 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -104.23 132.53 50.38 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.421 1.111 . . . . 0.0 109.29 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -58.87 114.88 2.76 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.834 0.854 . . . . 0.0 110.404 -174.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.5 mt -91.17 -42.66 10.32 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 156.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -145.47 149.03 33.92 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 169.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.12 144.25 12.8 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 168.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? -145.67 147.19 31.72 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.066 1.346 . . . . 0.0 107.689 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -132.19 150.44 52.15 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.834 1.654 . . . . 0.0 107.272 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -133.59 9.61 3.97 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.332 1.453 . . . . 0.0 110.597 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -129.2 150.18 50.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.283 1.433 . . . . 0.0 108.871 -169.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.16 -1.32 56.76 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.215 1.006 . . . . 0.0 112.98 -169.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 m -70.47 -34.32 72.26 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.683 0.674 . . . . 0.0 110.763 175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -140.56 67.23 30.05 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.058 0.943 . . . . 0.0 110.133 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -90.15 -2.71 5.42 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.705 2.27 . . . . 0.0 113.458 -174.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.4 m -135.45 145.75 47.52 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.003 0.921 . . . . 0.0 109.757 -169.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.5 t -45.54 -52.35 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 126.178 1.791 . . . . 0.0 113.036 -169.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.53 -45.5 88.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.755 0.707 . . . . 0.0 111.06 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.4 -35.06 65.8 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -177.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -61.12 -50.21 74.12 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.772 0.829 . . . . 0.0 110.047 174.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -60.14 -36.21 77.02 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.282 -0.886 . . . . 0.0 111.385 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.05 -47.64 76.63 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.09 0.556 . . . . 0.0 109.65 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -61.47 -37.66 84.43 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.432 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.2 -37.34 87.0 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.188 1.395 . . . . 0.0 112.042 176.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.92 -47.45 80.5 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.394 0.997 . . . . 0.0 109.236 172.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.31 -50.95 66.17 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.366 0.417 . . . . 0.0 110.551 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.5 -55.66 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 125.408 1.483 . . . . 0.0 108.415 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -66.8 -43.79 82.97 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 117.995 0.361 . . . . 0.0 110.782 -172.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.93 -50.39 70.86 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.59 0.356 . . . . 0.0 110.31 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.1 mmtm -66.16 -50.18 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 122.278 0.231 . . . . 0.0 110.531 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.402 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 38.4 p -70.82 -35.67 72.59 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -168.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.9 p-80 -71.08 -1.42 12.2 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 120.359 1.436 . . . . 0.0 112.266 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -122.72 23.16 9.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.57 1.948 . . . . 0.0 109.726 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.2 m -132.94 160.01 38.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.977 1.711 . . . . 0.0 108.268 -177.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -80.99 28.88 0.35 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.754 1.621 . . . . 0.0 113.282 -169.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 3.9 m 67.69 -177.62 0.21 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.168 1.787 . . . . 0.0 113.725 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 10.6 pt-20 57.91 -46.01 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 131.522 3.929 . . . . 0.0 117.078 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.4 tt -152.88 154.64 7.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 120.461 1.482 . . . . 0.0 109.785 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.11 174.08 13.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.65 1.58 . . . . 0.0 109.01 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.37 105.73 6.38 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 178.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.8 mt -127.84 132.56 49.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 52.98 26.58 4.83 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.655 1.182 . . . . 0.0 112.515 176.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 1.74 77.67 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.815 1.198 . . . . 0.0 113.945 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -112.22 142.8 44.26 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 119.381 1.59 . . . . 0.0 110.622 -177.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.9 m -75.12 141.07 43.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 171.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.68 134.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.18 147.3 15.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.193 -1.781 . . . . 0.0 106.193 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 32.5 p90 -156.68 158.57 37.21 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.969 0.414 . . . . 0.0 111.677 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -147.3 175.22 10.94 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.125 0.97 . . . . 0.0 108.383 169.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 p -145.15 149.06 34.31 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.0 m -147.69 147.42 29.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.326 1.05 . . . . 0.0 109.274 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 mp 49.53 -87.65 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 126.937 2.095 . . . . 0.0 112.109 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -145.26 26.0 1.35 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.849 2.06 . . . . 0.0 109.277 -176.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 62.3 tp -131.23 147.43 52.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.388 1.875 . . . . 0.0 109.347 -169.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -126.41 145.18 50.57 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.3 139.81 49.65 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.454 1.502 . . . . 0.0 107.422 -172.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -146.24 147.86 31.87 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.824 0.85 . . . . 0.0 111.029 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 93.5 t -135.68 127.82 46.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 169.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mm -114.63 135.83 53.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -171.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.19 173.64 32.01 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.84 1.244 . . . . 0.0 112.019 -172.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -68.96 167.92 14.8 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.13 -1.535 . . . . 0.0 111.139 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.0 m -61.14 -46.97 88.39 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 170.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 10.3 t80 50.23 -167.11 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.048 2.139 . . . . 0.0 112.084 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -83.83 -14.91 50.11 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.589 -0.694 . . . . 0.0 111.405 171.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -161.19 163.13 31.37 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 124.89 1.276 . . . . 0.0 110.398 -172.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.09 -6.39 10.91 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.858 2.463 . . . . 0.0 110.452 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.17 -32.76 72.5 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 124.947 1.299 . . . . 0.0 110.571 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -64.06 -33.33 75.5 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.847 0.749 . . . . 0.0 111.601 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.4 mt -72.64 -44.24 62.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.6 mmt -54.33 -42.01 69.71 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.374 172.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -48.49 77.43 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.542 0.737 . . . . 0.0 110.236 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.93 -44.67 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.018 0.527 . . . . 0.0 110.277 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 47.3 tp -60.39 -51.84 67.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 118.618 0.645 . . . . 0.0 110.035 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -71.55 -31.83 67.45 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 118.584 -0.722 . . . . 0.0 110.989 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.76 -49.63 76.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.082 0.855 . . . . 0.0 109.659 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.72 -46.12 89.57 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.739 0.699 . . . . 0.0 110.709 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.74 -43.57 98.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.013 0.525 . . . . 0.0 111.346 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.73 -36.61 67.8 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 121.432 -0.792 . . . . 0.0 110.886 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.7 m -63.62 -44.15 94.77 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.765 0.711 . . . . 0.0 110.927 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.5 mt -52.26 -53.62 41.56 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.0 m -55.84 -40.42 72.83 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.412 0.445 . . . . 0.0 111.565 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -67.64 -43.75 79.58 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.999 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 12.5 ptt? -83.37 -29.05 28.52 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.59 1.086 . . . . 0.0 112.312 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.3 tp -88.79 -33.48 17.42 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.2 0.6 . . . . 0.0 112.24 -169.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 49.96 33.09 6.24 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.936 1.694 . . . . 0.0 114.132 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -153.1 -174.93 5.11 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.909 1.684 . . . . 0.0 106.908 169.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -48.19 125.77 9.87 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 m -78.01 45.13 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.616 1.166 . . . . 0.0 109.322 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -80.4 163.85 23.53 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.751 0.82 . . . . 0.0 109.994 176.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -59.11 -36.52 75.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -169.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.0 tpp85 -65.4 -42.02 93.03 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.013 0.824 . . . . 0.0 110.138 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -67.58 -33.41 74.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.478 0.581 . . . . 0.0 110.787 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.5 -44.59 86.53 Favored 'General case' 0 N--CA 1.461 0.094 0 O-C-N 121.404 -0.81 . . . . 0.0 110.905 171.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.79 -38.38 72.43 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.435 0.694 . . . . 0.0 110.862 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.29 -21.99 65.66 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.24 27.27 5.37 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.466 1.03 . . . . 0.0 112.977 -175.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -40.88 -48.47 3.12 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 125.666 1.586 . . . . 0.0 112.922 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.7 -39.61 94.55 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.985 0.811 . . . . 0.0 111.304 -177.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.13 -43.56 92.99 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -58.22 -51.06 71.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.322 1.049 . . . . 0.0 110.298 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -56.29 -46.03 79.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.332 0.653 . . . . 0.0 109.961 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.85 -40.41 91.68 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-O 118.885 -0.579 . . . . 0.0 111.372 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.76 -46.45 90.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.93 0.786 . . . . 0.0 109.694 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.6 -46.47 86.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.302 0.501 . . . . 0.0 109.904 175.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.46 -21.83 66.53 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 112.936 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -92.01 -28.72 17.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.895 0.878 . . . . 0.0 110.656 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.1 mt -80.06 -37.46 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 118.967 0.803 . . . . 0.0 109.525 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 20.6 t -140.14 143.67 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.308 1.043 . . . . 0.0 108.923 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -145.69 134.55 22.45 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.584 1.154 . . . . 0.0 107.982 169.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.82 29.46 54.89 Favored Glycine 0 CA--C 1.533 1.156 0 CA-C-O 119.537 -0.591 . . . . 0.0 112.965 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.33 14.38 79.3 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 117.98 0.89 . . . . 0.0 113.949 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 26.6 t -120.04 135.54 60.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 24.1 pt -60.96 157.38 2.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-O 121.141 0.496 . . . . 0.0 110.411 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.5 mt -118.18 -48.48 2.53 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 124.272 1.029 . . . . 0.0 108.765 173.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -157.14 156.54 32.86 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.153 1.381 . . . . 0.0 107.563 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.4 p -140.44 17.26 2.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.986 0.914 . . . . 0.0 111.801 -174.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.66 114.96 63.09 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 169.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.38 -32.84 31.52 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.968 1.779 . . . . 0.0 113.025 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.15 -48.84 74.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.696 0.68 . . . . 0.0 109.183 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -66.22 -40.93 90.65 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.347 -0.846 . . . . 0.0 109.948 -175.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -56.75 -57.07 10.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 123.866 0.866 . . . . 0.0 109.509 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.23 -39.63 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.406 0.548 . . . . 0.0 110.466 -172.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -63.04 -44.05 96.97 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.637 0.653 . . . . 0.0 110.311 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -61.09 -46.24 91.45 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.672 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.68 -27.23 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 119.606 1.094 . . . . 0.0 111.881 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.53 -38.83 74.28 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.858 0.753 . . . . 0.0 111.281 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 49.1 mt -71.01 -38.54 72.63 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.827 0.851 . . . . 0.0 110.944 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.246 176.43 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.4 ttt . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -152.91 -172.2 4.17 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.905 0.882 . . . . 0.0 110.564 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 40.59 -92.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.732 2.813 . . . . 0.0 114.181 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.0 -31.6 65.26 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.218 1.007 . . . . 0.0 111.283 -177.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.5 mt -132.79 55.78 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 173.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -59.01 -32.41 69.69 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.714 0.806 . . . . 0.0 111.118 174.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -117.88 84.1 20.02 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 125.028 1.331 . . . . 0.0 108.717 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.49 12.51 0.85 Allowed 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 123.388 2.725 . . . . 0.0 112.396 172.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 m -57.85 -20.68 38.07 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.156 2.182 . . . . 0.0 113.831 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -65.7 -11.04 41.82 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.8 0.84 . . . . 0.0 113.152 172.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 74.94 123.87 0.04 OUTLIER 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.019 2.927 . . . . 0.0 109.314 -170.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.9 p -68.85 -36.01 77.62 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -135.52 142.8 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 169.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -98.76 -25.82 14.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 117.636 -1.174 . . . . 0.0 109.978 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.19 166.49 29.59 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.672 1.123 . . . . 0.0 112.059 174.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.95 133.06 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 104.654 -2.35 . . . . 0.0 104.654 172.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.6 mt -135.09 149.96 50.15 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.8 mt -138.91 124.22 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.532 -2.395 . . . . 0.0 104.532 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.9 mt -121.47 147.95 45.08 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -173.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.23 168.15 12.88 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.552 0.692 . . . . 0.0 109.727 169.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -55.11 -20.49 10.13 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.0 0.83 30.38 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.62 1.1 . . . . 0.0 111.494 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.06 17.44 43.56 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.953 1.263 . . . . 0.0 112.771 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.89 137.93 39.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.305 1.552 . . . . 0.0 109.878 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -60.33 120.62 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 175.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.2 mt -97.67 -44.53 6.73 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 163.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -145.23 151.3 38.18 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.123 173.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.51 144.69 15.6 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 169.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.428 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -147.51 148.97 31.76 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.77 1.228 . . . . 0.0 107.856 171.877 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -136.88 148.1 46.87 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.779 1.631 . . . . 0.0 106.925 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -133.89 2.55 3.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.973 0.909 . . . . 0.0 111.568 -174.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -132.9 159.2 40.59 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.011 0.925 . . . . 0.0 108.991 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.87 5.57 3.16 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.274 2.23 . . . . 0.0 112.51 -174.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -61.62 -48.16 82.15 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.938 1.295 . . . . 0.0 110.58 177.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -143.9 73.69 16.6 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.533 1.133 . . . . 0.0 108.542 -177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.41 -0.69 6.02 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.654 2.236 . . . . 0.0 113.521 -171.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 m -135.04 139.78 45.08 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.061 0.944 . . . . 0.0 109.459 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -43.58 -53.04 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.607 1.963 . . . . 0.0 113.043 -169.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -62.51 -43.54 98.55 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.387 0.539 . . . . 0.0 111.115 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -68.93 -35.66 77.05 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -63.78 -50.97 66.91 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.367 0.667 . . . . 0.0 110.558 176.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.62 -37.64 73.63 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.398 -0.814 . . . . 0.0 110.877 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.21 -45.56 80.34 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -61.99 -37.95 86.76 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.101 0.56 . . . . 0.0 110.897 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.99 -42.17 97.29 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.751 1.62 . . . . 0.0 111.181 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -66.01 -42.26 89.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.472 -0.768 . . . . 0.0 109.919 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.55 -46.77 77.07 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.068 0.547 . . . . 0.0 110.849 173.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.9 mm -56.5 -54.95 22.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 C-N-CA 124.673 1.189 . . . . 0.0 108.301 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -60.14 -48.8 80.22 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.188 0.449 . . . . 0.0 110.842 -177.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -58.91 -39.76 82.49 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.549 1.14 . . . . 0.0 112.126 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -76.92 -47.49 20.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.135 0.574 . . . . 0.0 109.956 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.9 p -70.53 -26.81 63.74 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.454 -0.779 . . . . 0.0 112.403 -169.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -73.87 5.35 4.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.077 1.308 . . . . 0.0 112.428 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.08 14.09 9.79 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.309 1.844 . . . . 0.0 110.723 175.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.6 m -120.69 162.93 18.85 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.379 1.072 . . . . 0.0 109.318 -171.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -88.59 23.11 2.36 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.371 1.468 . . . . 0.0 112.992 -169.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.4 m 68.64 179.79 0.23 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 0.0 113.848 175.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.31 10.5 pt-20 56.94 -50.95 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 131.275 3.83 . . . . 0.0 116.13 -175.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.0 tt -151.54 155.29 7.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 120.377 1.444 . . . . 0.0 110.062 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.28 164.83 35.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.405 1.882 . . . . 0.0 109.23 -177.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.09 106.92 8.94 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 102.442 -3.17 . . . . 0.0 102.442 170.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mp -81.01 -64.51 1.17 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -168.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -139.8 7.15 2.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.592 1.557 . . . . 0.0 110.844 -172.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 144.84 -38.82 1.25 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 126.04 1.781 . . . . 0.0 109.383 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -80.01 139.44 36.97 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.137 0.975 . . . . 0.0 110.463 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 62.1 m -85.22 141.19 30.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.931 1.292 . . . . 0.0 107.556 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 93.7 t -138.19 131.3 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 106.338 -1.726 . . . . 0.0 106.338 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.6 m -107.91 145.29 15.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 169.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -156.86 159.19 37.95 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.93 0.395 . . . . 0.0 111.721 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -150.4 171.02 17.68 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.369 1.067 . . . . 0.0 108.562 170.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -143.71 140.89 30.24 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 m -146.77 142.07 27.37 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.541 0.737 . . . . 0.0 109.581 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 53.79 -85.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 127.176 2.191 . . . . 0.0 112.328 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -146.6 29.57 1.02 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.269 1.827 . . . . 0.0 108.911 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.0 tp -137.43 147.24 45.23 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.257 1.823 . . . . 0.0 109.446 -169.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -129.55 139.26 51.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -127.19 140.48 52.21 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.624 1.57 . . . . 0.0 107.938 -172.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -146.31 149.17 33.31 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.161 0.984 . . . . 0.0 111.396 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 86.0 t -140.6 140.76 33.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -130.82 134.99 61.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 -171.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.17 172.1 37.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-O 121.942 0.745 . . . . 0.0 113.065 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.4 m -63.08 129.27 39.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.207 1.403 . . . . 0.0 109.999 -173.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -77.01 33.45 0.15 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.204 1.802 . . . . 0.0 113.48 -172.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.08 169.57 8.25 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.21 1.004 . . . . 0.0 109.166 169.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.43 26.62 0.05 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.115 1.766 . . . . 0.0 113.484 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -138.09 46.78 2.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 125.785 1.634 . . . . 0.0 109.124 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -55.84 -14.97 2.7 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.439 -0.788 . . . . 0.0 111.603 169.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -51.12 -35.63 36.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.587 1.955 . . . . 0.0 111.213 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.1 ptt? -71.5 -32.77 68.6 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.566 1.076 . . . . 0.0 111.614 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.43 -48.2 73.56 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.21 -41.67 79.87 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 122.485 0.314 . . . . 0.0 110.341 178.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.26 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.737 0.815 . . . . 0.0 110.319 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.3 t -61.99 -44.38 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.077 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.91 -49.62 76.74 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.724 0.693 . . . . 0.0 110.493 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -63.34 -41.61 98.88 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 119.559 -0.258 . . . . 0.0 110.482 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.2 t -60.92 -49.98 75.26 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.193 0.597 . . . . 0.0 109.621 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.14 -45.66 90.87 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -60.69 -47.92 84.09 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.58 -36.52 78.84 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.75 -0.594 . . . . 0.0 111.409 -177.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 61.2 m -59.04 -48.2 82.46 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.748 0.819 . . . . 0.0 110.631 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 36.2 mt -53.82 -50.71 65.57 Favored 'General case' 0 C--N 1.342 0.264 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 174.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.6 m -55.77 -37.91 69.18 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.677 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -70.81 -55.71 7.94 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.169 1.349 . . . . 0.0 110.141 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -74.25 -29.85 61.87 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.821 -170.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 16.2 tp -88.71 -34.72 17.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.107 0.563 . . . . 0.0 111.388 -174.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.289 0.0 OUTLIER 41.04 48.82 2.96 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.887 1.675 . . . . 0.0 112.684 -173.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -136.83 179.63 6.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.043 2.137 . . . . 0.0 106.402 169.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -70.53 14.67 0.12 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.278 25.3 m 44.49 40.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 127.122 2.169 . . . . 0.0 112.142 -173.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.15 165.72 24.51 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.391 0.677 . . . . 0.0 111.093 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -46.37 -51.61 14.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.429 1.892 . . . . 0.0 112.904 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -67.29 -41.38 85.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.139 0.427 . . . . 0.0 110.275 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.45 -34.96 79.42 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.646 -0.659 . . . . 0.0 110.523 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.5 mp -64.87 -46.97 79.56 Favored 'General case' 0 CA--C 1.521 -0.172 0 O-C-N 121.269 -0.894 . . . . 0.0 110.895 172.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.7 tp -55.2 -37.16 66.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.404 0.682 . . . . 0.0 111.081 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -70.37 -18.81 63.06 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.43 25.14 4.46 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.649 1.113 . . . . 0.0 113.014 -174.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -41.21 -47.35 3.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.467 1.507 . . . . 0.0 112.419 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.92 -39.43 94.16 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.037 0.835 . . . . 0.0 111.903 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.06 -43.75 98.34 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.2 tp -57.95 -49.37 77.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.977 0.911 . . . . 0.0 110.684 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -55.83 -47.63 76.89 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.483 0.583 . . . . 0.0 109.61 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.2 mt -67.57 -35.91 79.92 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.291 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.8 90.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.732 0.696 . . . . 0.0 109.85 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.6 t -57.44 -43.84 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 118.801 0.728 . . . . 0.0 109.648 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.07 3.82 3.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.139 0.976 . . . . 0.0 113.611 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -120.34 -27.13 5.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.605 1.562 . . . . 0.0 110.988 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.97 -39.7 77.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.255 0.934 . . . . 0.0 108.851 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.23 157.93 43.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.837 0.827 . . . . 0.0 110.738 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -145.62 130.1 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.951 1.7 . . . . 0.0 106.744 169.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.65 32.42 53.95 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.377 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.59 19.82 76.72 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.377 1.088 . . . . 0.0 113.662 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 72.4 t -124.64 139.56 50.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 174.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.18 135.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.346 0.593 . . . . 0.0 110.092 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -116.82 -42.24 2.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.714 1.606 . . . . 0.0 108.354 -173.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -147.86 152.1 37.05 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -131.5 -12.68 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.693 1.197 . . . . 0.0 111.428 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.76 117.04 62.07 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.337 0.971 . . . . 0.0 108.638 169.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.36 -31.68 27.66 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.24 1.96 . . . . 0.0 112.152 -172.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -44.38 85.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.614 -0.679 . . . . 0.0 109.319 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.89 -38.79 92.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.635 0.652 . . . . 0.0 110.544 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.6 t -56.71 -52.31 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 118.86 0.754 . . . . 0.0 109.366 173.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.9 t -63.14 -38.53 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.966 0.803 . . . . 0.0 110.499 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.2 -39.75 93.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.153 0.888 . . . . 0.0 110.822 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -64.34 -46.01 85.33 Favored 'General case' 0 CA--C 1.526 0.034 0 CA-C-N 118.723 0.692 . . . . 0.0 110.543 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.96 -40.69 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 118.904 0.774 . . . . 0.0 109.618 177.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.04 -33.74 72.35 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.569 0.748 . . . . 0.0 112.1 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 30.9 mt -72.64 -32.7 66.1 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.062 0.945 . . . . 0.0 111.936 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 . . . . . 0 C--O 1.25 1.088 0 CA-C-N 118.336 0.517 . . . . 0.0 109.898 178.08 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.1 ttm . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.2 mp0 -62.25 152.43 33.48 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.287 1.035 . . . . 0.0 110.219 178.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.53 -14.37 60.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -177.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -157.95 167.95 28.5 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 127.35 2.26 . . . . 0.0 107.598 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.59 128.04 23.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 173.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 75.3 mt -140.19 157.12 46.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 126.008 1.723 . . . . 0.0 107.059 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 28.54 63.72 0.7 Allowed Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 127.751 2.42 . . . . 0.0 113.112 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.5 166.7 24.8 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.704 2.936 . . . . 0.0 112.019 -173.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -122.43 26.39 8.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.268 1.427 . . . . 0.0 109.997 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tt -144.22 128.93 18.24 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 104.832 -2.285 . . . . 0.0 104.832 -177.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -57.12 133.95 55.45 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.807 0.843 . . . . 0.0 110.292 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.1 p -74.7 -34.81 62.7 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.9 t -132.03 139.98 49.01 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -106.85 -30.11 9.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.705 176.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.19 167.48 26.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.83 1.196 . . . . 0.0 111.847 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.5 mt -139.45 135.22 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 172.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.15 154.6 49.17 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.7 mt -139.61 120.42 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.669 -2.715 . . . . 0.0 103.669 169.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.12 143.57 48.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.613 0.765 . . . . 0.0 109.459 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -67.61 168.74 10.56 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 168.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -14.71 61.96 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.1 0.96 . . . . 0.0 112.244 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -74.63 -9.52 58.65 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.139 0.975 . . . . 0.0 112.207 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.24 52.89 9.8 Favored Glycine 0 C--N 1.341 0.849 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -172.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -136.92 131.44 33.07 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.633 1.173 . . . . 0.0 109.306 -173.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -59.66 107.23 0.57 Allowed 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.868 0.867 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 mt -73.83 -37.34 64.88 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 155.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -143.2 148.92 37.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.615 1.566 . . . . 0.0 107.851 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.89 141.89 10.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.4 OUTLIER -149.35 148.28 29.32 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.607 1.563 . . . . 0.0 107.714 176.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.43 152.24 46.9 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.711 1.604 . . . . 0.0 108.056 -173.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -136.12 -4.21 2.17 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.214 1.005 . . . . 0.0 112.581 -174.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -134.2 158.53 43.47 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.12 0.873 . . . . 0.0 110.037 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.4 2.05 6.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.144 2.177 . . . . 0.0 112.747 -172.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 p -59.71 -48.44 81.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.65 1.18 . . . . 0.0 110.431 174.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -145.16 75.61 13.85 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.5 1.12 . . . . 0.0 108.704 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -90.36 -0.99 5.38 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.714 2.276 . . . . 0.0 113.695 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -135.51 140.13 44.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 119.14 0.882 . . . . 0.0 109.943 -169.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.3 t -45.41 -50.4 3.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.532 1.933 . . . . 0.0 113.062 -169.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -57.9 -48.72 79.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.545 0.611 . . . . 0.0 110.927 -176.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.91 -35.13 72.15 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -63.29 -51.2 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.592 0.757 . . . . 0.0 110.924 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -62.01 -32.61 73.11 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.026 -1.046 . . . . 0.0 111.246 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.88 71.77 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.3 -38.96 88.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.998 0.919 . . . . 0.0 111.513 178.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -61.0 -48.96 79.4 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.046 1.738 . . . . 0.0 110.59 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -68.76 -35.43 77.07 Favored 'General case' 0 N--CA 1.463 0.175 0 O-C-N 121.75 -0.594 . . . . 0.0 110.903 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -47.83 76.9 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.536 0.734 . . . . 0.0 110.553 169.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.4 mt -61.56 -47.34 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.278 0.631 . . . . 0.0 109.703 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -60.42 -47.09 87.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.631 0.65 . . . . 0.0 109.961 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -54.58 -48.02 72.61 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.059 0.943 . . . . 0.0 111.524 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.8 mmmt -69.97 -49.36 52.47 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.306 0.642 . . . . 0.0 110.016 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 39.2 p -70.3 -27.46 64.41 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.638 -0.664 . . . . 0.0 111.818 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -62.14 -17.96 59.46 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.895 0.77 . . . . 0.0 111.943 170.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -117.59 25.04 10.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.313 1.845 . . . . 0.0 110.036 -175.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.8 m -132.55 158.22 42.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.841 1.656 . . . . 0.0 107.608 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.82 -41.8 98.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.1 m 141.89 -174.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 1 C-N-CA 132.531 4.332 . . . . 0.0 108.633 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.335 10.1 pt-20 61.08 -47.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 131.366 3.866 . . . . 0.0 116.859 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.61 152.54 10.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 120.198 1.363 . . . . 0.0 109.871 -175.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.79 165.18 31.33 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.404 1.882 . . . . 0.0 108.72 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -134.42 104.42 6.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 103.132 -2.914 . . . . 0.0 103.132 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -67.48 -63.09 1.13 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.358 -169.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -149.34 1.75 0.54 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.394 2.278 . . . . 0.0 110.308 -174.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.39 -35.95 1.21 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.03 1.776 . . . . 0.0 109.962 -171.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.0 mt -72.07 125.35 27.05 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 170.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 m -82.04 141.57 33.08 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.6 t -131.23 137.18 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.96 135.87 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -157.85 171.17 20.78 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.593 0.711 . . . . 0.0 112.072 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.9 tttp -153.94 157.08 38.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.026 1.73 . . . . 0.0 106.788 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -137.71 133.07 33.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -152.98 144.03 23.03 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.152 0.581 . . . . 0.0 110.401 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 mt 65.0 -84.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.403 1.881 . . . . 0.0 109.475 173.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -150.82 21.07 0.79 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.818 1.647 . . . . 0.0 109.52 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.9 tp -125.77 147.25 49.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 126.787 2.035 . . . . 0.0 110.144 -168.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -129.38 134.64 47.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -123.75 138.62 54.48 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.148 1.379 . . . . 0.0 107.501 -169.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -144.8 150.3 36.93 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.643 1.11 . . . . 0.0 112.099 -170.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.0 t -137.26 140.7 41.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 127.441 2.296 . . . . 0.0 104.953 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -131.14 135.87 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 -177.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.47 175.74 30.97 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-O 122.802 1.223 . . . . 0.0 112.502 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.9 m -61.21 154.17 24.16 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 112.599 -1.8 . . . . 0.0 110.639 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.4 m -57.01 -39.11 74.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.327 0.651 . . . . 0.0 109.881 171.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 5.9 t80 48.98 -143.59 0.48 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.689 1.996 . . . . 0.0 110.683 169.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.47 6.73 6.31 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.157 1.383 . . . . 0.0 111.625 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -159.19 163.19 36.21 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.489 1.516 . . . . 0.0 109.049 174.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -120.89 -6.87 9.56 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.436 2.294 . . . . 0.0 110.472 175.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.2 mt -57.17 -35.33 69.43 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 125.832 1.653 . . . . 0.0 110.655 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -65.06 -34.16 77.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.582 0.628 . . . . 0.0 111.912 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -73.51 -40.88 63.7 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.8 -45.57 70.8 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.982 . . . . 0.0 110.373 169.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.41 75.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.257 1.023 . . . . 0.0 110.387 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.5 t -61.34 -44.56 98.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 C-N-CA 123.3 0.64 . . . . 0.0 110.006 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.4 tp -60.15 -48.99 79.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.2 0.455 . . . . 0.0 110.274 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -61.37 -44.82 96.51 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 119.47 -0.3 . . . . 0.0 110.4 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 94.6 m -62.5 -45.53 92.57 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 118.885 -0.579 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.6 tp -65.95 -46.19 79.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.195 0.907 . . . . 0.0 110.819 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -64.16 -41.99 96.92 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 117.981 0.355 . . . . 0.0 110.799 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.76 -39.55 84.14 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.571 -0.705 . . . . 0.0 110.801 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.1 m -59.8 -48.05 83.25 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.323 0.649 . . . . 0.0 110.734 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -52.88 -48.86 66.83 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -60.24 -27.13 66.96 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.355 -0.831 . . . . 0.0 113.028 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.5 mm-40 -81.9 -53.33 6.25 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 120.12 1.327 . . . . 0.0 110.771 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -78.75 -33.79 46.27 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -168.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.56 -43.87 68.58 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.304 0.956 . . . . 0.0 109.104 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? 49.61 51.53 16.28 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.817 1.247 . . . . 0.0 110.048 -169.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -137.49 -171.37 2.96 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.762 2.425 . . . . 0.0 106.875 176.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -77.38 5.84 8.0 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.273 0.629 . . . . 0.0 112.113 175.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.324 4.8 m 49.2 40.34 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 126.91 2.084 . . . . 0.0 112.204 -174.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.27 168.83 18.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.128 0.971 . . . . 0.0 110.205 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -49.16 -48.23 45.1 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.605 1.162 . . . . 0.0 112.591 -176.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -66.4 -39.95 89.33 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 118.644 -0.694 . . . . 0.0 110.341 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.34 -36.88 85.17 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.201 0.91 . . . . 0.0 110.487 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.99 -47.06 78.89 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.769 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.3 tp -56.67 -38.06 71.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.69 0.677 . . . . 0.0 111.331 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.62 -19.08 64.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.03 0.932 . . . . 0.0 112.887 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -131.75 24.77 4.69 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.105 0.962 . . . . 0.0 111.561 -169.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -47.88 -47.66 31.7 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.917 1.287 . . . . 0.0 111.472 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -66.93 -36.34 82.02 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.241 0.473 . . . . 0.0 111.416 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.44 96.51 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.1 -49.07 79.09 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.685 1.194 . . . . 0.0 111.096 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -54.11 -48.42 70.76 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.983 0.811 . . . . 0.0 110.362 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 71.9 mt -68.43 -34.85 76.73 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.097 -0.478 . . . . 0.0 111.526 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.9 -44.94 83.79 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.925 0.784 . . . . 0.0 109.867 175.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.6 t -56.61 -45.29 82.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.8 -5.92 10.37 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.867 1.267 . . . . 0.0 113.686 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -112.3 -18.39 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 111.774 174.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 80.9 mt -81.4 -41.64 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.487 1.04 . . . . 0.0 108.467 172.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.9 p -145.0 148.11 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.267 1.027 . . . . 0.0 109.003 -169.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -146.89 136.44 22.93 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.8 29.58 50.41 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.928 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.68 14.86 81.69 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 118.171 0.986 . . . . 0.0 113.627 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.72 125.99 73.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.1 pt -57.93 145.72 8.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.3 pp -133.99 -13.33 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.022 0.929 . . . . 0.0 111.875 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -149.14 157.41 43.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.136 0.88 . . . . 0.0 108.964 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.7 p -143.93 31.06 1.28 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.809 1.643 . . . . 0.0 109.96 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -134.63 114.04 12.09 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 125.08 1.352 . . . . 0.0 107.897 178.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.82 -31.49 10.22 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.308 2.005 . . . . 0.0 112.16 -170.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -66.64 -45.38 79.21 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -71.98 -30.55 65.37 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.214 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.6 t -57.07 -54.62 27.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.612 1.096 . . . . 0.0 108.451 169.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.18 -36.18 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 119.159 0.89 . . . . 0.0 111.275 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -55.77 -49.82 72.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.134 0.879 . . . . 0.0 109.989 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -63.01 -40.66 98.44 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.407 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 69.3 t -59.37 -43.54 90.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.778 1.172 . . . . 0.0 109.935 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.7 75.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.307 0.643 . . . . 0.0 111.674 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.23 -37.39 80.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 125.966 1.706 . . . . 0.0 111.622 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 . . . . . 0 C--O 1.249 1.047 0 C-N-CA 123.999 0.919 . . . . 0.0 109.817 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.1 ttm . . . . . 0 N--CA 1.484 1.229 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -152.26 163.31 39.69 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.072 1.349 . . . . 0.0 108.518 178.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.82 -1.49 1.26 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.331 1.053 . . . . 0.0 112.502 176.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.3 mt -148.18 164.65 33.29 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.932 2.093 . . . . 0.0 106.823 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.11 114.78 1.83 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 169.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -74.06 -19.93 60.45 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.18 0.592 . . . . 0.0 112.351 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -131.08 76.12 77.18 Favored Pre-proline 0 CA--C 1.539 0.523 0 C-N-CA 124.872 1.269 . . . . 0.0 107.771 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.74 -29.36 19.29 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.644 2.229 . . . . 0.0 111.98 -176.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.7 m 53.27 20.85 2.04 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.474 1.91 . . . . 0.0 114.539 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.92 172.38 16.87 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.287 1.835 . . . . 0.0 107.848 169.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -59.4 122.01 12.88 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 176.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 36.1 p -72.35 -31.65 65.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 173.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 m -136.44 139.81 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 123.64 0.776 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -91.94 -36.01 13.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.183 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.27 167.25 24.24 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.239 0.927 . . . . 0.0 112.541 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.7 mt -135.32 135.7 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 104.789 -2.301 . . . . 0.0 104.789 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 mt -133.92 151.93 51.67 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.5 mt -139.72 120.21 14.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 169.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 mt -123.76 144.5 49.65 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -172.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 168.41 9.61 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.401 170.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -71.68 10.46 0.66 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.665 1.186 . . . . 0.0 113.881 -174.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.99 5.17 5.94 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.64 1.576 . . . . 0.0 110.621 169.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 6.02 58.25 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 125.286 1.422 . . . . 0.0 113.203 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -69.83 132.42 46.01 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.426 1.613 . . . . 0.0 109.865 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -60.21 123.75 18.18 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.3 mt -100.11 -41.27 7.2 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 162.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -147.86 152.12 37.08 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.431 0.692 . . . . 0.0 109.6 172.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.08 146.63 18.99 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 169.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -146.39 145.19 30.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 172.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -134.67 148.65 50.39 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 125.621 1.569 . . . . 0.0 106.855 -177.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -130.41 7.14 4.9 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.267 1.027 . . . . 0.0 110.684 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -133.66 147.38 51.42 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.081 0.952 . . . . 0.0 110.674 -170.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.61 -7.51 33.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.163 1.785 . . . . 0.0 114.483 -169.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.9 p -67.04 -35.29 79.57 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.646 1.112 . . . . 0.0 112.618 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -141.36 63.51 17.7 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 119.323 0.965 . . . . 0.0 111.231 -174.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -86.69 -1.39 8.21 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.98 2.454 . . . . 0.0 113.314 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.2 m -134.73 140.49 45.99 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.086 0.955 . . . . 0.0 109.511 -169.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.2 t -44.52 -52.63 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 126.338 1.855 . . . . 0.0 112.955 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.87 -43.24 98.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.683 0.674 . . . . 0.0 111.193 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.57 -33.97 64.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.4 -50.01 75.28 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-O 118.691 -0.671 . . . . 0.0 109.726 172.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -57.52 -37.2 72.64 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.176 0.898 . . . . 0.0 111.405 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.25 -50.13 72.96 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.313 0.645 . . . . 0.0 109.508 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.4 -37.48 87.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.847 0.459 . . . . 0.0 111.578 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.48 -45.74 91.64 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.131 1.772 . . . . 0.0 110.537 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.87 -42.94 97.39 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.903 -0.498 . . . . 0.0 109.993 175.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.0 -49.96 70.2 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.214 0.606 . . . . 0.0 110.888 173.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -58.05 -51.77 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.061 0 C-N-CA 123.974 0.91 . . . . 0.0 108.766 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -60.64 -47.91 84.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.371 0.532 . . . . 0.0 110.702 -174.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -56.65 -50.6 71.57 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 122.889 0.476 . . . . 0.0 110.855 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -64.83 -46.75 80.65 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.3 p -71.03 -32.62 69.42 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.669 -0.644 . . . . 0.0 111.822 -174.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -62.72 -12.73 25.71 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.368 -0.833 . . . . 0.0 111.701 170.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -122.34 25.02 9.12 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.063 1.745 . . . . 0.0 109.754 -175.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 99.2 m -133.06 161.64 33.84 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.834 1.653 . . . . 0.0 108.505 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -87.47 25.34 1.45 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.441 1.496 . . . . 0.0 113.426 -169.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.457 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 7.2 m 69.05 178.92 0.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.79 1.636 . . . . 0.0 113.728 176.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.6 pt-20 55.96 -46.56 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 131.107 3.763 . . . . 0.0 116.706 -174.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.8 tt -149.78 156.81 6.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 120.278 1.399 . . . . 0.0 109.62 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.87 158.29 43.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.479 1.912 . . . . 0.0 108.392 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -121.89 99.24 6.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 101.754 -3.424 . . . . 0.0 101.754 169.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.41 -62.3 1.61 Allowed 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 123.64 0.776 . . . . 0.0 112.217 -168.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -149.44 4.96 0.61 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.582 1.953 . . . . 0.0 110.783 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 142.75 -35.39 1.71 Allowed Glycine 0 CA--C 1.528 0.852 0 C-N-CA 126.353 1.93 . . . . 0.0 108.817 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.35 133.51 47.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.322 1.049 . . . . 0.0 108.418 169.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.3 m -90.2 144.11 26.16 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.6 t -136.54 137.89 47.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.3 m -119.92 146.18 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.457 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 25.7 p90 -157.74 160.27 37.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.091 0.472 . . . . 0.0 110.848 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -148.16 174.59 11.81 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.137 0.975 . . . . 0.0 108.63 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.7 p -140.57 145.46 36.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 171.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -146.79 142.29 27.58 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.69 0.796 . . . . 0.0 109.341 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.6 mp 53.03 -84.29 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.155 2.182 . . . . 0.0 111.454 -174.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -149.85 30.76 0.72 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.415 1.886 . . . . 0.0 109.06 -176.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.6 tp -137.83 148.18 45.22 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.203 1.401 . . . . 0.0 109.774 -169.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -124.9 146.55 49.27 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.926 0.891 . . . . 0.0 108.95 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -135.69 142.97 45.17 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.41 1.484 . . . . 0.0 107.96 -171.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -147.53 151.07 35.7 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.023 0.929 . . . . 0.0 111.258 -170.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -139.8 141.16 34.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 169.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.91 135.49 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 -173.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -167.71 -176.75 38.61 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-O 121.984 0.769 . . . . 0.0 113.532 -178.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.9 m -62.41 161.19 12.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.703 1.601 . . . . 0.0 111.605 -176.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.8 p -126.37 13.67 7.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.007 1.323 . . . . 0.0 111.966 -170.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 2.1 p90 -54.79 -50.4 68.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.772 1.629 . . . . 0.0 113.416 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -147.33 -23.3 0.39 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -172.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.64 155.35 38.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.097 0.862 . . . . 0.0 110.395 -170.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.12 -8.33 7.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.921 2.088 . . . . 0.0 110.68 175.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.4 mp -58.2 -33.93 69.83 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.975 1.31 . . . . 0.0 110.935 177.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -65.66 -33.84 76.82 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.906 0.775 . . . . 0.0 111.459 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 36.9 mt -70.42 -46.49 63.83 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.1 mmt -55.54 -40.44 71.87 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.305 173.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.76 71.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.847 0.859 . . . . 0.0 110.04 -178.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.61 -45.02 99.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 118.33 0.513 . . . . 0.0 110.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.97 -49.27 78.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.422 0.556 . . . . 0.0 110.312 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -63.52 -43.59 96.72 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.337 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 96.8 m -61.71 -45.32 94.46 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.32 -45.89 78.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.45 1.023 . . . . 0.0 110.861 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -62.41 -43.33 99.07 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.429 0.633 . . . . 0.0 110.997 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.22 -37.33 72.05 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.346 -0.846 . . . . 0.0 110.947 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -60.53 -48.54 81.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.512 0.597 . . . . 0.0 110.587 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.4 mt -50.72 -51.23 51.9 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 173.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -55.0 -42.61 72.72 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.872 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -69.42 -48.72 60.12 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 119.577 1.08 . . . . 0.0 111.777 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 11.6 ptt? -73.6 -28.72 61.97 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.459 1.027 . . . . 0.0 112.003 -174.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 21.1 tp -85.4 -35.02 21.59 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -171.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 52.26 28.88 6.01 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.307 1.443 . . . . 0.0 113.765 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -153.59 -178.25 6.89 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.235 1.814 . . . . 0.0 106.89 169.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -48.07 131.89 15.71 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.895 0.878 . . . . 0.0 109.195 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 29.9 m -79.99 38.95 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 124.733 1.213 . . . . 0.0 110.22 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -78.2 171.39 15.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.613 1.165 . . . . 0.0 111.772 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -44.88 -61.21 1.69 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.079 1.752 . . . . 0.0 112.667 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -61.93 -41.43 97.94 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.949 -0.469 . . . . 0.0 110.337 -179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.31 -31.54 67.55 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.822 -0.549 . . . . 0.0 112.098 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -77.76 -32.99 52.93 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.09 -1.006 . . . . 0.0 109.96 173.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.53 -33.88 71.95 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.736 0.698 . . . . 0.0 110.923 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -71.15 -17.83 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.27 -0.894 . . . . 0.0 113.265 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -129.98 28.44 5.06 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.453 1.024 . . . . 0.0 112.789 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.76 -48.14 2.17 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.921 1.688 . . . . 0.0 112.722 174.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.94 -37.9 89.17 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.111 0.869 . . . . 0.0 111.725 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.96 -43.51 95.84 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 176.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.25 -49.04 78.53 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.98 0.912 . . . . 0.0 110.879 173.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.08 -48.32 76.33 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.513 0.597 . . . . 0.0 109.396 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.75 -37.08 85.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.177 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.44 95.73 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.916 0.78 . . . . 0.0 110.593 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.8 t -60.38 -45.62 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 118.906 0.775 . . . . 0.0 109.09 174.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -73.49 18.2 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.064 1.346 . . . . 0.0 112.991 176.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -135.54 -25.67 1.29 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.665 1.586 . . . . 0.0 110.757 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.71 -29.09 8.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.356 1.062 . . . . 0.0 109.552 171.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.8 t -138.04 147.5 25.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 119.685 1.129 . . . . 0.0 108.638 -171.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -144.28 126.19 15.34 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 125.473 1.509 . . . . 0.0 107.366 169.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.9 32.29 59.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 119.431 -0.649 . . . . 0.0 113.657 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.76 12.52 84.43 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.264 1.032 . . . . 0.0 113.672 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.9 t -121.13 141.26 42.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 30.3 pt -55.17 140.26 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-O 121.959 0.885 . . . . 0.0 110.049 174.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -113.66 -44.22 3.22 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 126.621 1.968 . . . . 0.0 107.512 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -145.74 161.84 38.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.0 m -148.19 38.69 0.89 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.193 0.997 . . . . 0.0 110.679 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -132.95 117.44 14.94 Favored Pre-proline 0 C--O 1.235 0.335 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.65 -42.93 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.077 1.851 . . . . 0.0 113.01 -169.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.257 1.9 pp0? -69.38 -27.53 65.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.938 -1.101 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.58 -43.53 69.24 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 119.628 1.103 . . . . 0.0 109.741 175.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 11.7 t -52.46 -49.91 41.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 170.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.6 t -63.2 -39.28 84.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.697 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -57.57 -51.1 70.86 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 119.515 1.052 . . . . 0.0 109.273 175.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -62.56 -40.67 97.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.636 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.67 -43.3 96.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 120.071 1.305 . . . . 0.0 109.632 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.22 79.16 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.211 0.604 . . . . 0.0 111.512 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.31 -39.28 78.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.036 1.734 . . . . 0.0 111.974 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.139 1.376 . . . . 0.0 110.095 -176.178 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.588 0.232 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.3 164.2 23.37 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.863 -0.523 . . . . 0.0 110.005 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.82 163.64 38.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.17 1.388 . . . . 0.0 108.873 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.45 -36.01 75.15 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.333 0.653 . . . . 0.0 111.31 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.3 mm -120.49 48.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 106.652 -1.611 . . . . 0.0 106.652 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 59.7 tp -55.33 -35.67 65.41 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.551 -0.718 . . . . 0.0 110.34 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -138.21 146.76 53.05 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 126.531 1.932 . . . . 0.0 106.04 169.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.54 155.07 67.67 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.363 2.042 . . . . 0.0 110.922 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 m -78.59 14.22 1.36 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.83 1.252 . . . . 0.0 112.901 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -148.68 177.44 9.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.188 2.195 . . . . 0.0 107.212 -176.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -56.29 128.67 36.92 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -63.98 -34.8 78.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.055 0.942 . . . . 0.0 110.186 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -157.13 160.6 2.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -174.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -123.06 -40.0 2.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.947 1.299 . . . . 0.0 110.088 -175.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.97 168.8 23.84 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.432 0.56 . . . . 0.0 111.179 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.4 mt -137.4 137.1 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 105.282 -2.118 . . . . 0.0 105.282 173.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -134.29 150.23 50.97 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.2 mt -137.19 120.09 20.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 169.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.7 mt -124.13 143.04 50.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -170.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.46 168.47 8.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.475 170.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -72.4 13.82 0.3 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.643 1.177 . . . . 0.0 113.794 -174.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -131.32 6.34 4.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.883 1.673 . . . . 0.0 110.327 169.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.87 5.96 59.55 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.397 1.475 . . . . 0.0 113.403 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -70.21 131.86 44.87 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 119.526 1.663 . . . . 0.0 109.918 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -60.64 118.79 7.01 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.51 -41.54 8.13 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 165.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -146.5 152.53 39.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.14 146.86 20.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 169.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.439 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -142.16 139.23 32.03 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 171.606 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -127.56 147.84 50.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 174.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -129.23 8.84 5.59 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.125 0.57 . . . . 0.0 110.571 -177.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -141.05 152.25 44.69 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.431 0.692 . . . . 0.0 111.81 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.68 -7.76 23.04 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.371 1.868 . . . . 0.0 113.962 -174.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 p -58.91 -42.73 90.33 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.149 -0.969 . . . . 0.0 112.157 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -145.16 72.26 14.6 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 119.079 0.854 . . . . 0.0 109.925 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -90.34 -1.17 5.39 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.811 2.341 . . . . 0.0 113.35 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.3 m -132.44 137.09 47.15 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.567 -169.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.4 t -46.87 -48.37 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.299 1.84 . . . . 0.0 112.683 -169.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -57.5 -48.0 80.41 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.417 0.553 . . . . 0.0 111.024 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -74.31 -33.35 63.17 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -61.34 -51.3 69.43 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.066 0.546 . . . . 0.0 110.714 174.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -61.49 -32.31 72.32 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.054 -1.029 . . . . 0.0 111.215 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -48.43 72.26 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -61.34 -38.43 86.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.406 0.683 . . . . 0.0 111.195 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.33 -44.94 93.48 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.41 1.484 . . . . 0.0 111.15 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -43.59 98.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.155 0.434 . . . . 0.0 109.84 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.29 -48.48 74.02 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.634 0.773 . . . . 0.0 110.946 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -59.27 -53.37 49.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -60.17 -44.85 94.71 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.648 0.379 . . . . 0.0 110.624 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -61.95 -47.61 84.11 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.278 0.631 . . . . 0.0 111.489 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -74.48 -48.66 25.95 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 122.787 0.435 . . . . 0.0 110.355 -170.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 p -59.18 -35.35 73.41 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.264 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -54.16 -26.76 29.65 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -77.91 -16.94 57.83 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 119.05 0.841 . . . . 0.0 112.778 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.7 p -78.33 173.24 12.53 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.364 0.984 . . . . 0.0 111.4 -174.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.22 -5.22 48.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.303 1.041 . . . . 0.0 112.125 169.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 m 77.77 143.51 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.547 2.739 . . . . 0.0 113.762 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 127.29 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 1 C-N-CA 133.338 4.655 . . . . 0.0 108.703 172.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.0 tt -154.42 157.3 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.698 1.199 . . . . 0.0 109.002 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.04 166.73 27.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.693 2.397 . . . . 0.0 107.98 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 tp -130.05 112.24 13.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 174.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -84.23 -165.52 1.18 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.04 1.336 . . . . 0.0 108.962 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.89 19.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.339 2.256 . . . . 0.0 114.369 -173.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.96 -3.0 0.47 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.559 1.552 . . . . 0.0 112.621 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.3 mt -126.32 131.98 51.72 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 118.353 1.076 . . . . 0.0 109.525 -170.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.0 m -75.68 141.61 42.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 84.5 t -137.97 117.94 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -98.2 146.23 8.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 169.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -155.66 162.72 40.54 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.989 0.359 . . . . 0.0 111.136 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -148.4 176.03 10.63 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.205 1.002 . . . . 0.0 108.636 170.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.6 p -141.26 148.6 40.09 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 m -144.7 141.87 29.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.0 mt 62.74 -78.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 126.879 2.072 . . . . 0.0 111.13 170.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -156.9 34.59 0.3 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.668 1.987 . . . . 0.0 108.931 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.5 tp -145.13 149.67 35.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.099 1.36 . . . . 0.0 109.784 -169.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -126.51 148.68 49.67 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.53 1.132 . . . . 0.0 109.231 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -137.34 140.55 41.55 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 125.378 1.471 . . . . 0.0 107.968 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -145.13 149.03 34.28 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 123.948 0.899 . . . . 0.0 110.501 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 96.5 t -136.32 136.54 48.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 169.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -127.44 137.77 56.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 -170.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -158.24 -177.39 31.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-O 121.742 0.635 . . . . 0.0 112.11 -176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 m -58.76 158.12 8.53 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.136 1.374 . . . . 0.0 112.188 -174.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 p -74.46 38.5 0.12 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.458 1.903 . . . . 0.0 111.058 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -69.05 167.93 14.94 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.978 1.311 . . . . 0.0 111.029 -171.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.69 -10.25 50.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.455 1.102 . . . . 0.0 113.375 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -148.01 171.19 16.22 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.903 1.281 . . . . 0.0 108.889 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.53 3.63 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.233 2.213 . . . . 0.0 110.76 -170.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.83 -31.68 72.78 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.472 1.109 . . . . 0.0 110.868 -173.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -33.44 75.82 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.871 0.759 . . . . 0.0 111.332 173.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.2 mt -71.19 -44.7 64.92 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.2 mmt -56.03 -41.0 74.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.282 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.39 -47.04 80.74 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.472 0.709 . . . . 0.0 110.3 -178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.1 t -62.01 -45.66 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-O 118.696 -0.668 . . . . 0.0 109.943 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 58.8 tp -61.21 -47.73 84.76 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.874 0.761 . . . . 0.0 110.331 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -64.56 -43.63 93.31 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.32 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 45.8 t -60.62 -50.61 72.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.268 0.627 . . . . 0.0 109.685 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.0 tp -61.97 -46.48 89.1 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.319 0.509 . . . . 0.0 110.992 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -64.67 -42.39 95.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.312 0.506 . . . . 0.0 111.046 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.73 -37.73 82.58 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 121.435 -0.791 . . . . 0.0 110.644 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.2 m -61.5 -46.73 88.77 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.664 0.785 . . . . 0.0 110.84 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.9 mt -54.72 -47.98 73.08 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.0 m -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.859 0.464 . . . . 0.0 111.879 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -73.12 -55.22 6.77 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.824 1.193 . . . . 0.0 109.69 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 67.0 mtm -66.03 -41.94 90.24 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.276 0.36 . . . . 0.0 111.751 -169.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.95 -35.86 77.26 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 118.041 0.382 . . . . 0.0 110.601 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.94 27.87 6.0 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.849 1.259 . . . . 0.0 112.455 -174.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -155.61 -175.34 5.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 126.739 2.016 . . . . 0.0 107.99 174.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.29 125.88 22.61 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.978 0.911 . . . . 0.0 108.789 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.3 m -77.95 46.73 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 125.371 1.468 . . . . 0.0 110.857 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.33 167.79 20.96 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.274 -0.891 . . . . 0.0 111.423 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -44.8 -54.17 6.64 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.104 1.762 . . . . 0.0 112.355 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -40.27 88.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.143 -0.348 . . . . 0.0 110.525 -176.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.5 -34.93 79.36 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.973 -0.455 . . . . 0.0 111.428 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.0 mp -67.87 -43.57 79.1 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 119.191 0.905 . . . . 0.0 110.46 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 69.7 tp -56.02 -37.26 68.95 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.28 0.491 . . . . 0.0 110.848 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -70.13 -18.81 63.24 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.279 1.032 . . . . 0.0 113.169 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -129.14 23.2 5.63 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.565 1.075 . . . . 0.0 111.442 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.65 -47.59 20.13 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.219 1.408 . . . . 0.0 111.832 -178.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -63.92 -39.73 94.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.941 0.791 . . . . 0.0 111.515 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.78 -43.6 95.97 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 tp -58.81 -50.44 73.95 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.287 1.035 . . . . 0.0 110.653 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -54.43 -49.03 70.94 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.481 0.712 . . . . 0.0 109.719 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.47 -33.87 76.01 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.601 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.94 80.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 118.859 0.754 . . . . 0.0 110.014 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 72.9 t -60.49 -41.04 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 118.658 0.663 . . . . 0.0 109.95 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.58 -24.83 67.96 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.402 0.681 . . . . 0.0 112.534 177.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -87.05 -34.73 19.08 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.576 -0.702 . . . . 0.0 110.683 177.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.86 -39.22 45.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.765 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 23.9 t -137.66 148.18 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 120.274 1.397 . . . . 0.0 111.851 -169.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -150.66 133.02 15.52 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.847 1.659 . . . . 0.0 108.033 169.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.66 24.99 54.84 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-O 119.487 -0.618 . . . . 0.0 114.632 173.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.07 18.33 69.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.379 1.09 . . . . 0.0 112.856 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.92 141.67 44.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.9 pt -70.55 154.96 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 119.684 -0.806 . . . . 0.0 109.859 176.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.6 mt -118.9 -19.28 8.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.029 1.331 . . . . 0.0 110.021 169.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -155.37 160.83 41.01 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 108.623 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -143.6 -5.98 0.81 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.558 1.143 . . . . 0.0 112.262 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.07 118.63 70.29 Favored Pre-proline 0 C--O 1.236 0.375 0 CA-C-N 119.735 1.152 . . . . 0.0 109.359 170.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -67.55 -30.94 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.902 1.735 . . . . 0.0 112.273 -174.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -64.64 -47.64 77.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -62.9 -38.69 91.94 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 118.392 0.542 . . . . 0.0 110.215 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.24 -58.49 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 30.1 m -67.0 -32.84 59.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.653 -173.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -61.13 -52.22 65.8 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.404 1.002 . . . . 0.0 109.987 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 80.0 mtt180 -61.52 -44.46 97.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 118.543 0.61 . . . . 0.0 110.091 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 15.2 t -58.45 -47.99 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.32 0.648 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.67 -29.92 56.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 122.681 0.392 . . . . 0.0 111.341 -171.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.27 -34.29 65.71 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.37 0.668 . . . . 0.0 111.108 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.1 mtm-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-N 118.375 0.534 . . . . 0.0 110.167 174.912 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 ttp . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -65.02 155.26 35.25 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.186 0.594 . . . . 0.0 110.195 176.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.63 146.86 52.94 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.239 0.616 . . . . 0.0 109.91 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -64.15 -50.04 69.72 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 173.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 38.1 mm -84.99 69.49 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 106.465 -1.68 . . . . 0.0 106.465 169.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.94 153.72 20.51 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 169.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -54.22 117.64 13.65 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 123.669 0.788 . . . . 0.0 108.943 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.4 151.81 23.09 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.11 1.873 . . . . 0.0 111.897 -169.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 p -75.02 -35.86 61.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.726 0.81 . . . . 0.0 109.126 169.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.4 tp -60.04 142.32 54.21 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.37 1.468 . . . . 0.0 109.426 170.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -56.16 130.29 43.63 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.566 1.147 . . . . 0.0 110.577 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.2 p -70.75 -32.09 69.13 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.408 0.683 . . . . 0.0 110.287 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.2 m -139.3 167.34 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.315 1.046 . . . . 0.0 109.173 -179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -131.25 -27.94 1.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 117.369 -1.301 . . . . 0.0 110.591 173.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.77 165.66 29.98 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 120.179 1.354 . . . . 0.0 112.123 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.9 mt -135.03 136.85 51.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 169.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -133.57 149.75 51.64 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.5 mt -138.32 118.86 15.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 104.276 -2.49 . . . . 0.0 104.276 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 55.9 mt -122.71 144.92 48.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 -175.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.5 169.11 6.42 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.086 0.47 . . . . 0.0 110.519 169.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.78 -11.97 1.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.0 3.49 13.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.049 1.34 . . . . 0.0 110.743 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.16 6.41 55.69 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.09 1.328 . . . . 0.0 112.85 171.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.79 128.08 35.38 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 119.564 1.682 . . . . 0.0 109.869 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -60.9 120.83 10.93 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -101.96 -41.73 6.36 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 166.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -145.81 151.99 38.8 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.53 144.53 15.47 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 168.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -148.2 147.85 29.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -132.7 145.61 51.18 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -131.6 1.15 4.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.295 1.038 . . . . 0.0 111.493 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -134.05 162.62 31.59 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.925 0.89 . . . . 0.0 108.914 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -71.78 4.2 3.48 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.495 1.918 . . . . 0.0 113.611 -169.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -62.24 -48.5 79.66 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.445 1.098 . . . . 0.0 111.275 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -143.94 74.99 16.1 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 124.162 0.985 . . . . 0.0 108.989 -176.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.23 -1.88 6.96 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.582 2.188 . . . . 0.0 113.568 -172.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.6 m -134.22 139.21 45.63 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.098 0.959 . . . . 0.0 109.238 -169.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -43.73 -52.85 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.431 1.893 . . . . 0.0 112.98 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.99 -42.11 98.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.464 0.575 . . . . 0.0 111.28 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.27 -34.62 73.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -64.85 -49.81 69.08 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.289 0.635 . . . . 0.0 110.292 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.56 -35.69 70.66 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.449 -0.782 . . . . 0.0 111.033 177.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.44 -43.58 73.02 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.961 0.505 . . . . 0.0 109.932 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -62.43 -37.88 87.56 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.071 -0.393 . . . . 0.0 110.759 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -64.99 -43.12 93.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.72 1.608 . . . . 0.0 111.005 178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -59.27 -46.58 88.13 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.267 0.485 . . . . 0.0 109.86 172.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -46.67 83.58 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.731 0.812 . . . . 0.0 111.1 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.3 mm -57.43 -53.52 42.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 124.417 1.087 . . . . 0.0 108.344 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.46 -48.4 81.94 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.651 0.38 . . . . 0.0 110.366 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -56.95 -43.67 81.78 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.031 0.932 . . . . 0.0 111.911 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -76.36 -48.9 18.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.053 0.541 . . . . 0.0 109.937 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.9 p -65.96 -30.23 70.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.672 -0.642 . . . . 0.0 112.048 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -56.64 -24.42 48.09 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.486 -0.758 . . . . 0.0 111.782 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -110.64 21.41 16.6 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.31 1.444 . . . . 0.0 110.485 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.7 m -128.87 153.51 47.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.392 1.077 . . . . 0.0 109.322 -173.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -83.21 93.79 7.74 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.182 0.993 . . . . 0.0 109.048 176.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.435 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 2.4 m -45.4 140.85 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.468 1.907 . . . . 0.0 115.96 -171.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 144.73 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 1 C-N-CA 133.223 4.609 . . . . 0.0 107.231 170.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -151.92 156.93 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.833 1.253 . . . . 0.0 109.041 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 171.75 17.61 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.398 2.279 . . . . 0.0 107.559 173.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 tt -142.23 117.7 10.27 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.86 -1.904 . . . . 0.0 105.86 169.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 mp -111.94 103.75 11.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -169.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 61.34 -2.25 0.24 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.196 2.198 . . . . 0.0 115.324 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.8 -27.91 1.3 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 126.021 1.772 . . . . 0.0 111.33 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -85.77 132.64 34.09 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 118.314 1.057 . . . . 0.0 108.873 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 m -82.82 140.67 32.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 175.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 89.7 t -139.21 138.24 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -173.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.9 m -123.91 149.77 28.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.435 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 28.6 p90 -157.32 165.99 34.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.503 0.668 . . . . 0.0 111.876 -175.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -151.16 159.6 44.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 127.305 2.242 . . . . 0.0 106.641 -169.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -138.42 144.45 40.18 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.7 m -138.74 119.65 14.34 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.039 1.336 . . . . 0.0 108.432 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.3 mp 62.58 -76.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 126.781 2.032 . . . . 0.0 113.061 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -143.39 21.84 1.86 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.607 1.563 . . . . 0.0 109.943 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.89 149.99 52.29 Favored 'General case' 0 N--CA 1.458 -0.075 0 C-N-CA 125.616 1.566 . . . . 0.0 109.387 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -130.4 142.18 50.52 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.983 1.313 . . . . 0.0 108.183 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -124.08 142.78 50.9 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.349 1.459 . . . . 0.0 107.087 -177.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -142.98 147.82 35.8 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.76 0.824 . . . . 0.0 109.251 -176.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.91 138.41 50.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.95 136.96 57.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 -172.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.07 -179.5 27.75 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-O 122.133 0.852 . . . . 0.0 112.192 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.4 m -59.62 165.89 2.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.696 1.599 . . . . 0.0 112.192 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -67.66 6.6 0.62 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.919 1.688 . . . . 0.0 114.541 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.29 122.94 17.85 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -175.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.16 -18.69 63.74 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.081 1.352 . . . . 0.0 114.555 -169.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -66.2 -32.43 73.86 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.705 -170.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.282 2.0 pp20? 48.39 -10.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.23 3.012 . . . . 0.0 118.463 -176.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 33.2 mt -63.8 -32.22 73.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 120.441 -1.412 . . . . 0.0 111.18 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -33.96 77.08 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.185 0.902 . . . . 0.0 111.532 174.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.3 mt -68.65 -47.35 66.77 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 19.2 mmt -55.4 -41.59 72.92 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.458 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.1 -51.69 66.92 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.282 0.633 . . . . 0.0 109.503 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.45 -44.81 99.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.223 0.465 . . . . 0.0 110.34 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.3 tp -61.31 -49.28 77.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.329 0.513 . . . . 0.0 110.471 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -65.21 -40.59 94.36 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.412 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.6 m -61.68 -46.94 87.56 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.442 0.565 . . . . 0.0 110.091 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.26 -51.35 66.52 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 118.55 0.613 . . . . 0.0 110.033 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -58.07 -47.18 83.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.215 0.606 . . . . 0.0 111.427 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -79.9 -29.21 39.83 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.474 -0.766 . . . . 0.0 111.894 -173.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.2 t -68.62 -43.55 76.11 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 119.249 0.931 . . . . 0.0 110.085 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 37.2 mt -53.33 -49.81 66.3 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 169.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.0 m -60.13 -32.01 70.61 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.22 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 35.3 mm-40 -65.82 -62.26 1.6 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 120.013 1.278 . . . . 0.0 109.513 174.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -72.65 -36.55 68.01 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -169.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 20.1 tp -73.88 -30.94 62.91 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.847 0.294 . . . . 0.0 111.352 -172.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 58.27 28.14 16.22 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.171 1.388 . . . . 0.0 113.08 172.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -150.15 176.56 10.73 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.935 2.094 . . . . 0.0 106.705 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -55.01 129.74 39.05 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.385 0.674 . . . . 0.0 109.719 169.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 24.5 m -81.5 48.06 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 109.727 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.11 176.74 4.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.124 -0.985 . . . . 0.0 111.737 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -46.84 -57.87 4.48 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.364 1.866 . . . . 0.0 112.836 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -64.8 -37.42 87.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.368 0.531 . . . . 0.0 110.674 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.26 -32.61 72.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.409 0.284 . . . . 0.0 110.879 -177.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.5 mp -75.02 -38.54 61.49 Favored 'General case' 0 CA--C 1.514 -0.404 0 O-C-N 120.594 -1.316 . . . . 0.0 111.821 172.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.7 tp -55.96 -39.28 71.55 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.48 0.582 . . . . 0.0 110.62 174.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -75.87 -10.57 59.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.33 24.93 4.16 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.726 1.148 . . . . 0.0 113.246 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -43.97 -44.9 7.51 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.042 1.337 . . . . 0.0 112.233 177.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.73 -40.73 95.82 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.042 0.837 . . . . 0.0 111.776 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.48 -42.95 98.82 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 176.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -55.75 -49.02 74.23 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.112 0.965 . . . . 0.0 110.449 172.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -58.03 -45.84 86.28 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.622 0.646 . . . . 0.0 109.851 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.09 -37.45 85.81 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 119.118 -0.468 . . . . 0.0 111.356 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.38 90.42 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 119.016 0.825 . . . . 0.0 110.096 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.97 -46.34 87.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.721 0.691 . . . . 0.0 109.746 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.7 -30.72 68.99 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.959 0.904 . . . . 0.0 112.661 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -85.79 -29.8 23.52 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.746 -0.596 . . . . 0.0 111.323 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 68.5 mt -78.99 -41.62 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.307 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -145.96 153.25 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 119.918 1.236 . . . . 0.0 110.836 -170.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -155.84 141.44 17.85 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.885 1.274 . . . . 0.0 108.799 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.61 25.08 54.85 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.423 -0.654 . . . . 0.0 114.125 173.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 86.35 8.81 77.24 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 118.077 0.939 . . . . 0.0 113.203 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.3 t -127.44 142.25 44.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 119.305 1.552 . . . . 0.0 106.953 -177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -62.37 155.93 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.598 0.713 . . . . 0.0 110.33 171.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.6 mt -122.69 -23.41 5.12 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.919 1.688 . . . . 0.0 109.834 171.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -154.55 161.31 41.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.935 0.789 . . . . 0.0 109.315 173.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 9.1 p -144.74 34.17 1.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.406 1.482 . . . . 0.0 110.448 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.68 120.84 6.7 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.908 0.883 . . . . 0.0 109.924 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -64.73 -33.36 54.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.188 2.592 . . . . 0.0 114.608 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.292 2.5 pp0? -84.42 -27.38 27.63 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.09 0.859 . . . . 0.0 111.523 -176.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -68.74 -40.68 79.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.018 1.281 . . . . 0.0 108.755 168.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.3 t -55.09 -53.22 36.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 118.223 -0.894 . . . . 0.0 108.78 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.28 -37.12 79.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 119.966 1.257 . . . . 0.0 111.132 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 -48.44 81.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.584 0.629 . . . . 0.0 109.515 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -68.27 -34.74 76.73 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.853 0.751 . . . . 0.0 111.636 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 48.7 t -61.98 -43.81 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 119.182 0.901 . . . . 0.0 109.448 174.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.97 -32.12 73.14 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.506 0.594 . . . . 0.0 111.426 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 37.4 tp -73.16 -24.83 60.62 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.86 1.664 . . . . 0.0 112.293 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 . . . . . 0 C--O 1.25 1.123 0 CA-C-N 118.597 0.635 . . . . 0.0 110.257 172.728 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.682 0.277 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -62.16 -34.05 75.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.852 . . . . 0.0 111.289 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -146.46 152.39 38.94 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.411 1.884 . . . . 0.0 106.926 171.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -61.28 143.94 54.75 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.221 0.464 . . . . 0.0 110.559 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 21.0 mt 46.45 57.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 125.514 1.526 . . . . 0.0 109.114 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.08 -25.99 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.997 0.919 . . . . 0.0 112.561 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -123.56 78.85 55.15 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.01 171.04 18.73 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.508 2.806 . . . . 0.0 111.667 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.1 m -73.43 5.57 3.63 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.375 1.47 . . . . 0.0 114.045 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -147.95 174.8 11.53 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.203 1.401 . . . . 0.0 110.074 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -60.01 128.76 38.44 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.742 0.817 . . . . 0.0 110.669 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 32.4 p -71.34 -32.0 68.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 171.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.5 140.8 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -100.52 -25.25 14.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 117.513 -1.232 . . . . 0.0 109.787 171.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.1 167.77 23.72 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.768 1.167 . . . . 0.0 111.89 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mt -138.96 139.29 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mt -138.25 154.4 49.07 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.3 mt -138.05 120.46 18.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 103.814 -2.662 . . . . 0.0 103.814 168.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.9 mt -125.99 145.46 50.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -169.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 170.73 3.39 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.678 0.791 . . . . 0.0 110.905 170.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -63.48 2.33 0.44 Allowed 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -131.32 9.66 4.78 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.688 1.595 . . . . 0.0 110.738 175.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.09 19.97 48.22 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 118.645 -1.086 . . . . 0.0 113.095 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -78.34 132.68 37.52 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.778 1.789 . . . . 0.0 109.697 171.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 ttm180 -61.53 116.83 5.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.354 0.662 . . . . 0.0 109.673 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mt -85.53 -43.27 13.67 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 157.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -148.87 148.48 29.91 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.953 1.301 . . . . 0.0 108.188 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.03 146.7 14.41 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.414 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 3.3 mmpt? -141.28 149.14 40.88 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.65 1.58 . . . . 0.0 107.733 172.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -139.68 144.55 37.64 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.614 1.566 . . . . 0.0 107.596 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -135.0 -1.96 2.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.316 1.047 . . . . 0.0 112.041 -170.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -134.4 160.04 39.2 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.47 0.708 . . . . 0.0 109.447 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.95 3.89 4.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.846 2.059 . . . . 0.0 112.871 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -61.03 -47.62 85.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.663 1.185 . . . . 0.0 110.819 177.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -144.07 75.08 15.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.312 1.045 . . . . 0.0 108.888 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -90.03 -1.01 5.61 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.726 2.284 . . . . 0.0 113.687 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 m -134.34 137.87 44.49 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.017 0.927 . . . . 0.0 109.463 -169.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.7 t -46.09 -49.84 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.066 1.746 . . . . 0.0 112.866 -169.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.18 -47.68 82.67 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.559 0.618 . . . . 0.0 111.019 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -73.92 -32.47 63.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.148 0.431 . . . . 0.0 110.36 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -61.79 -51.15 69.45 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.089 0.555 . . . . 0.0 110.594 174.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.18 -35.55 75.62 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.354 -0.841 . . . . 0.0 110.85 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.53 78.59 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.57 -38.54 87.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 110.916 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.38 -42.75 99.66 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.465 1.506 . . . . 0.0 111.08 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -65.49 -41.97 92.66 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.583 0.629 . . . . 0.0 109.985 174.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.418 HD22 HD13 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -55.89 -46.16 78.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.052 0.541 . . . . 0.0 111.11 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.9 mm -60.56 -52.4 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -60.44 -46.01 91.6 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.742 0.701 . . . . 0.0 110.521 -177.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -55.66 -47.39 76.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.869 0.867 . . . . 0.0 111.628 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -67.69 -52.12 41.59 Favored 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 123.28 0.632 . . . . 0.0 110.227 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 36.2 p -70.7 -33.43 70.87 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.845 -0.534 . . . . 0.0 112.207 -169.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -64.71 -12.86 51.26 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.139 -0.976 . . . . 0.0 111.961 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -111.03 13.81 21.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.612 1.965 . . . . 0.0 111.361 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.8 m -120.33 159.48 24.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.556 1.142 . . . . 0.0 109.111 -176.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.24 31.84 0.45 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.675 1.59 . . . . 0.0 112.824 -169.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m 68.24 178.03 0.25 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.392 1.877 . . . . 0.0 113.603 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 11.1 pt-20 56.25 -44.05 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.415 3.886 . . . . 0.0 117.138 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -150.44 154.29 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 120.305 1.412 . . . . 0.0 109.259 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.15 163.8 36.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.839 2.056 . . . . 0.0 108.798 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.28 120.87 34.38 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.418 HD13 HD22 ' A' ' 47' ' ' ASN . 3.2 mm? -111.18 71.1 0.73 Allowed 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 126.167 1.787 . . . . 0.0 107.632 -172.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 62.84 7.95 2.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.533 1.533 . . . . 0.0 113.815 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 145.95 -33.91 1.47 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.327 1.918 . . . . 0.0 110.42 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.22 156.78 38.77 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.615 0.766 . . . . 0.0 109.141 170.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -117.06 138.77 51.39 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 77.8 t -136.33 139.31 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 -169.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.1 t -132.9 131.22 59.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -156.81 164.61 37.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -168.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 pttp -154.68 179.04 9.44 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.496 0.719 . . . . 0.0 109.232 169.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 p -138.34 146.06 41.89 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.4 m -147.9 146.03 28.88 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.461 1.104 . . . . 0.0 109.592 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 52.52 -83.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 127.03 2.132 . . . . 0.0 110.882 -172.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -152.81 29.43 0.52 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.82 2.048 . . . . 0.0 109.226 -176.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.2 tp -136.7 153.42 50.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.436 1.494 . . . . 0.0 110.27 -169.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -122.91 149.29 44.43 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.324 1.05 . . . . 0.0 109.125 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -136.89 141.56 42.75 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.587 1.555 . . . . 0.0 107.873 -172.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -145.18 150.24 36.39 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.074 0.95 . . . . 0.0 112.004 -169.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.4 t -137.19 138.74 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.51 137.91 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.7 -179.7 36.54 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.505 1.058 . . . . 0.0 113.006 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -172.94 0.67 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.595 -1.803 . . . . 0.0 109.658 175.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.8 t -142.35 161.34 38.27 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -155.23 -50.1 0.09 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.346 1.059 . . . . 0.0 109.285 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -150.4 -18.32 0.24 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.676 0.79 . . . . 0.0 111.828 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.414 ' C ' HD21 ' A' ' 86' ' ' ASN . 0.1 OUTLIER -155.48 171.74 19.41 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 123.823 0.849 . . . . 0.0 111.085 -175.208 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -1.4 14.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.729 2.412 . . . . 0.0 110.518 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.35 -32.69 68.77 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.733 1.213 . . . . 0.0 111.697 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -34.34 76.39 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.722 0.692 . . . . 0.0 111.274 177.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -69.45 -43.45 73.25 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 46.0 mmm -59.72 -40.11 86.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.348 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.84 76.9 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.766 0.827 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.26 -43.18 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 118.583 -0.722 . . . . 0.0 110.185 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 tp -60.85 -48.51 81.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.112 0.869 . . . . 0.0 110.477 178.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -62.7 -46.4 88.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 119.341 -0.362 . . . . 0.0 110.317 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 89.7 m -60.61 -46.73 89.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.911 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.2 tp -61.01 -52.36 65.33 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 119.187 0.903 . . . . 0.0 111.024 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -66.01 -40.62 91.26 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.065 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.12 -31.58 66.16 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.497 -0.752 . . . . 0.0 111.311 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 71.0 m -62.58 -49.84 73.66 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.614 0.765 . . . . 0.0 110.312 172.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 74.8 mt -53.07 -46.64 68.66 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.3 m -58.68 -41.12 85.46 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 118.552 -0.737 . . . . 0.0 112.104 178.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -67.39 -42.04 83.99 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 119.828 1.195 . . . . 0.0 111.419 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.0 ptp -76.75 -36.22 57.24 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.14 0.882 . . . . 0.0 111.622 -175.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.85 -33.95 24.74 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 118.663 0.665 . . . . 0.0 112.015 -173.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 50.15 29.9 3.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.591 1.156 . . . . 0.0 112.822 -176.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -154.84 -178.07 6.96 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 126.316 1.847 . . . . 0.0 107.486 169.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -53.78 121.17 7.35 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.511 0.672 . . . . 0.0 111.104 176.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.1 m -79.32 50.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.373 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.98 175.99 6.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.041 0.936 . . . . 0.0 111.974 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -46.88 -56.56 6.12 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.369 1.468 . . . . 0.0 112.279 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -62.37 -44.47 96.4 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.137 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.69 83.76 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.501 0.591 . . . . 0.0 110.329 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.25 -38.04 75.05 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 118.498 -0.763 . . . . 0.0 112.081 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.24 -38.38 76.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.903 0.774 . . . . 0.0 110.831 176.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -72.04 -14.71 61.94 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -125.06 21.34 8.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.506 1.048 . . . . 0.0 111.923 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -48.37 -49.51 34.34 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.444 1.098 . . . . 0.0 112.215 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.49 -36.49 81.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.617 0.644 . . . . 0.0 111.361 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.15 -43.88 98.5 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 173.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -61.2 -49.34 77.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.68 1.192 . . . . 0.0 110.845 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -53.17 -49.96 65.59 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.131 0.878 . . . . 0.0 110.068 175.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 65.0 mt -65.89 -41.38 91.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 119.179 -0.439 . . . . 0.0 111.037 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.52 93.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.598 0.636 . . . . 0.0 110.294 178.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.9 t -57.81 -44.39 86.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 118.288 0.495 . . . . 0.0 109.702 175.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -66.77 -5.75 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.606 1.162 . . . . 0.0 113.63 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -112.15 -28.81 7.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.017 1.327 . . . . 0.0 110.555 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 82.5 mt -66.97 -43.17 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.453 1.024 . . . . 0.0 108.723 171.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.45 155.19 28.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 124.303 1.041 . . . . 0.0 109.856 -174.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -149.67 131.44 15.06 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.221 1.408 . . . . 0.0 107.814 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.22 30.78 55.65 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 119.28 -0.733 . . . . 0.0 113.201 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.59 12.56 84.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 118.268 1.034 . . . . 0.0 113.846 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 t -123.72 141.41 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.155 1.478 . . . . 0.0 107.038 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.0 pt -55.71 138.7 15.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.456 0.646 . . . . 0.0 110.174 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -122.1 -38.8 2.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.126 1.77 . . . . 0.0 108.564 -172.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.55 153.39 43.52 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 169.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.3 m -133.37 28.21 4.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.216 1.407 . . . . 0.0 110.305 -169.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -139.22 125.72 12.52 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.229 1.012 . . . . 0.0 108.71 176.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.23 -38.39 3.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.843 2.362 . . . . 0.0 113.71 -171.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -28.11 57.58 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.032 -1.043 . . . . 0.0 110.433 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 68.0 mm-40 -61.8 -50.41 72.41 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.326 0.966 . . . . 0.0 109.748 169.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 12.3 t -51.98 -57.14 4.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 124.103 0.961 . . . . 0.0 109.02 177.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.5 t -63.56 -43.68 98.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.756 -173.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -57.36 -52.57 64.83 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 118.44 0.564 . . . . 0.0 109.643 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -57.32 -47.14 82.31 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.113 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 33.1 m -75.9 -28.47 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-N 120.385 1.448 . . . . 0.0 112.031 -172.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.96 -35.31 62.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.526 0.603 . . . . 0.0 110.981 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 52.6 tp -67.9 -41.2 83.07 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.961 1.704 . . . . 0.0 111.27 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 124.478 1.111 . . . . 0.0 110.03 -179.373 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.7 mtt . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -63.81 -32.67 74.26 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.217 0.607 . . . . 0.0 111.495 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.7 162.65 40.66 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.859 1.663 . . . . 0.0 108.165 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.6 -33.17 72.34 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.182 0.593 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.2 mm -109.56 51.72 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 62.2 tp -53.95 -37.64 64.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.756 -0.59 . . . . 0.0 110.134 172.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.94 147.11 49.69 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 126.561 1.945 . . . . 0.0 106.069 169.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.29 166.65 29.01 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.603 2.202 . . . . 0.0 111.048 174.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.6 m -131.45 13.88 5.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.684 1.194 . . . . 0.0 111.479 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -151.4 165.64 33.49 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.611 1.964 . . . . 0.0 106.913 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -57.87 120.1 7.87 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.3 p -73.19 -23.14 60.37 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.886 -176.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.3 m -138.87 163.04 27.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 C-N-CA 123.906 0.882 . . . . 0.0 108.754 173.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -123.04 -28.12 4.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 117.247 -1.358 . . . . 0.0 110.166 171.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.82 165.31 30.47 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 120.094 1.315 . . . . 0.0 112.144 175.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.3 mt -133.23 133.8 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 170.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -131.19 146.46 52.34 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.5 mt -142.69 114.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 103.419 -2.808 . . . . 0.0 103.419 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.2 mt -124.89 148.1 48.48 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.419 0.688 . . . . 0.0 109.318 -169.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.79 170.55 13.38 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.915 169.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -60.26 -17.15 40.06 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -99.56 -14.31 19.08 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.647 1.112 . . . . 0.0 110.939 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.58 12.22 13.48 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 125.674 1.606 . . . . 0.0 112.239 175.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.93 132.04 47.14 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.158 1.479 . . . . 0.0 109.751 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -68.23 82.59 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.716 1.607 . . . . 0.0 109.853 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.42 -47.95 77.22 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -148.99 150.68 33.25 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.682 0.793 . . . . 0.0 109.116 171.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.29 145.74 19.48 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 169.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -147.95 148.07 30.37 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -134.21 144.65 48.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -130.04 0.44 4.73 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.169 0.988 . . . . 0.0 111.514 -172.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -133.8 161.78 33.79 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.671 0.788 . . . . 0.0 109.244 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -72.68 4.9 3.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.476 1.91 . . . . 0.0 113.071 -169.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.8 p -62.67 -48.77 77.88 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.713 1.205 . . . . 0.0 110.954 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -143.24 73.36 17.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.311 1.045 . . . . 0.0 109.026 -176.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -88.28 -1.47 6.91 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.727 2.285 . . . . 0.0 113.582 -171.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.5 m -133.29 138.13 46.29 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.213 1.005 . . . . 0.0 109.012 -170.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -45.4 -50.59 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 126.133 1.773 . . . . 0.0 112.999 -169.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -60.28 -43.96 95.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.724 0.693 . . . . 0.0 111.07 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -71.53 -33.5 69.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.049 0.386 . . . . 0.0 110.104 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -62.32 -49.6 74.98 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.073 0.549 . . . . 0.0 110.047 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.37 -37.78 75.94 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.309 -0.869 . . . . 0.0 111.137 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.38 77.65 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.978 0.511 . . . . 0.0 109.681 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -61.94 -37.53 85.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.117 0.567 . . . . 0.0 110.914 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -63.74 -42.81 97.8 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.455 1.502 . . . . 0.0 111.059 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -62.61 -43.42 98.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.316 0.962 . . . . 0.0 109.812 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.71 -48.76 77.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.979 0.512 . . . . 0.0 110.983 175.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.83 -51.99 63.46 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 C-N-CA 124.149 0.98 . . . . 0.0 108.969 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -59.34 -47.16 86.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.185 0.594 . . . . 0.0 110.107 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -60.21 -48.17 82.86 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.541 0.736 . . . . 0.0 111.361 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -70.13 -43.07 71.72 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.423 0.689 . . . . 0.0 110.827 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.8 p -67.5 -34.28 76.82 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.562 -0.712 . . . . 0.0 111.087 -176.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -65.51 -7.03 12.39 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.1 0.864 . . . . 0.0 112.853 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -119.11 25.02 10.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.689 1.996 . . . . 0.0 109.432 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 84.2 m -129.51 153.07 48.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.516 1.927 . . . . 0.0 107.211 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.99 -45.66 92.66 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.514 -173.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.5 m 145.81 -175.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 1 C-N-CA 132.458 4.303 . . . . 0.0 108.39 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.4 pt-20 57.76 -49.21 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 130.981 3.712 . . . . 0.0 116.413 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.1 tt -152.96 153.67 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 120.798 1.636 . . . . 0.0 110.484 -173.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -145.5 159.93 42.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.227 1.411 . . . . 0.0 110.232 171.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -113.56 99.07 7.47 Favored 'General case' 0 CA--C 1.52 -0.204 1 N-CA-C 100.065 -4.05 . . . . 0.0 100.065 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.6 tp -65.32 -66.36 0.56 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.033 -168.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -146.22 6.97 1.01 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.332 1.853 . . . . 0.0 110.263 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.27 -41.46 1.25 Allowed Glycine 0 CA--C 1.526 0.744 0 C-N-CA 126.361 1.934 . . . . 0.0 108.283 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.9 mt -66.61 139.68 57.9 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 169.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.3 m -98.98 142.81 29.99 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.44 142.15 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 m -111.42 147.63 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 169.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -152.79 157.59 41.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.088 0.47 . . . . 0.0 110.73 174.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.449 ' HE2' ' CE2' ' A' ' 98' ' ' PHE . 18.1 ptmt -144.49 171.37 14.45 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 169.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 m -140.44 137.91 34.3 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -145.12 140.56 28.1 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.225 0.61 . . . . 0.0 109.864 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.9 mp 50.36 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 127.358 2.263 . . . . 0.0 111.374 -169.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -142.61 16.27 1.99 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.471 1.908 . . . . 0.0 110.492 -176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.1 145.99 44.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.846 2.058 . . . . 0.0 108.097 -169.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.24 138.08 53.02 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -134.13 139.15 45.71 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.61 1.164 . . . . 0.0 108.039 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -144.78 147.11 32.53 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.862 0.865 . . . . 0.0 110.059 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 70.9 t -137.82 131.08 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.0 139.46 48.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 -172.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -157.39 179.23 33.3 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-O 122.58 1.1 . . . . 0.0 113.074 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -62.4 156.04 23.66 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.266 1.826 . . . . 0.0 112.73 -171.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -71.81 33.35 0.06 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 127.575 2.35 . . . . 0.0 112.325 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -70.96 179.0 2.9 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.846 1.658 . . . . 0.0 111.285 -172.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -63.96 -12.94 42.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.085 1.754 . . . . 0.0 113.333 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -146.04 163.69 34.46 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.137 0.975 . . . . 0.0 110.172 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -7.15 7.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.833 2.453 . . . . 0.0 110.298 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -56.99 -36.34 70.25 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.79 1.636 . . . . 0.0 110.368 177.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -64.78 -34.9 79.43 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.1 0.56 . . . . 0.0 112.161 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -47.71 69.03 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -42.68 67.69 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.201 1.0 . . . . 0.0 110.052 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.71 65.35 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.006 1.322 . . . . 0.0 110.212 -177.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.97 -44.04 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.136 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 65.9 tp -61.2 -48.04 83.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 118.506 0.593 . . . . 0.0 110.341 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.56 -44.45 96.31 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 119.126 -0.464 . . . . 0.0 110.406 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.6 m -61.47 -45.9 92.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.275 0.489 . . . . 0.0 110.473 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.71 -49.3 68.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.478 0.581 . . . . 0.0 109.968 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.449 ' CE2' ' HE2' ' A' ' 70' ' ' LYS . 51.3 t80 -62.23 -42.22 99.12 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.899 0.381 . . . . 0.0 111.114 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -69.62 -37.27 76.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.533 -0.73 . . . . 0.0 110.647 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.5 m -62.97 -44.79 95.07 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.731 0.696 . . . . 0.0 111.221 175.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.8 mt -52.55 -51.46 59.58 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.6 m -58.44 -40.41 82.5 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.602 0.564 . . . . 0.0 111.097 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -66.74 -44.34 81.76 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.59 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -81.54 -30.64 33.05 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.782 1.174 . . . . 0.0 112.179 -177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -75.78 -44.66 40.38 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 119.154 0.888 . . . . 0.0 111.907 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 50.85 34.65 10.66 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.23 1.012 . . . . 0.0 111.973 -170.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -152.8 -176.92 5.95 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.784 1.633 . . . . 0.0 108.15 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -50.29 126.33 14.64 Favored 'General case' 0 CA--C 1.522 -0.112 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 35.1 m -76.04 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.399 1.48 . . . . 0.0 110.002 169.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.04 174.78 9.47 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.425 1.09 . . . . 0.0 110.805 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -52.08 -48.62 64.59 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.614 1.166 . . . . 0.0 112.304 -170.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 41.7 tpt85 -65.88 -35.92 81.98 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.907 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.0 -39.23 66.2 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.733 0.697 . . . . 0.0 111.107 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.03 -45.97 86.09 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 121.563 -0.711 . . . . 0.0 109.351 171.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 67.3 tp -61.34 -38.38 86.71 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.202 0.601 . . . . 0.0 111.793 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -65.29 -28.11 69.1 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.94 21.85 9.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.803 0.729 . . . . 0.0 112.531 -169.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.56 -50.77 2.22 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 125.564 1.546 . . . . 0.0 112.691 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -65.58 -39.24 91.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.076 0.853 . . . . 0.0 111.541 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.74 -43.17 99.35 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.11 -49.42 77.94 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.123 0.969 . . . . 0.0 110.605 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.58 -46.87 80.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.758 0.708 . . . . 0.0 109.708 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -65.75 -40.05 91.69 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.084 -0.484 . . . . 0.0 110.749 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.98 96.6 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.981 0.81 . . . . 0.0 110.125 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.77 -46.11 90.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 118.923 -0.56 . . . . 0.0 109.727 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -63.42 -25.47 68.29 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -84.85 -40.03 17.6 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.626 -0.671 . . . . 0.0 111.228 173.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.37 -42.54 87.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 119.136 0.88 . . . . 0.0 109.799 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -139.05 150.07 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.072 0 CA-C-N 119.245 0.929 . . . . 0.0 110.592 -174.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -149.97 132.96 16.17 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 125.059 1.344 . . . . 0.0 108.365 177.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.74 25.98 56.77 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.506 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 79.56 14.27 81.47 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.299 1.049 . . . . 0.0 113.255 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 20.2 t -126.73 141.43 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 119.257 1.529 . . . . 0.0 107.388 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -57.31 138.67 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.658 0.742 . . . . 0.0 109.852 172.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -125.3 -36.63 2.47 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.321 1.849 . . . . 0.0 108.21 -172.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -140.19 156.63 46.43 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 169.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.3 m -151.21 39.34 0.67 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.302 -0.874 . . . . 0.0 110.936 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -140.71 120.19 8.55 Favored Pre-proline 0 C--O 1.234 0.284 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 -29.69 17.91 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.108 1.872 . . . . 0.0 111.622 -169.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -69.41 -42.65 74.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -66.61 -43.63 84.29 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 41.4 t -55.85 -55.14 19.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.473 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.9 p -63.96 -41.21 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 119.051 0.841 . . . . 0.0 110.556 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -64.01 -43.42 95.68 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.003 0.82 . . . . 0.0 110.235 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.07 -48.06 83.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.378 0.536 . . . . 0.0 110.307 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.9 m -73.68 -26.57 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 119.247 0.93 . . . . 0.0 111.387 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.89 -34.9 74.16 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.739 0.699 . . . . 0.0 111.2 172.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.3 mp -75.83 -30.27 58.92 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.02 0.928 . . . . 0.0 111.947 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 118.535 0.607 . . . . 0.0 109.835 175.074 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.936 0.398 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.11 171.03 17.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.176 1.39 . . . . 0.0 108.975 176.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.78 150.26 41.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.597 0.759 . . . . 0.0 110.283 175.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.15 -30.7 62.55 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.36 1.064 . . . . 0.0 111.825 178.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.6 pp -120.13 37.0 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.244 1.817 . . . . 0.0 110.758 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -52.49 -39.94 61.8 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -139.0 139.19 22.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 127.069 2.148 . . . . 0.0 105.244 168.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.36 164.45 35.58 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 122.474 2.116 . . . . 0.0 110.96 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 m -68.41 -16.58 63.97 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.148 0.979 . . . . 0.0 113.63 -176.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -153.34 -178.78 7.2 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.227 1.411 . . . . 0.0 110.452 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -38.16 129.73 1.26 Allowed 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.27 2.228 . . . . 0.0 112.639 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -72.38 -28.12 62.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.071 0.548 . . . . 0.0 110.688 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.49 164.01 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.335 1.054 . . . . 0.0 108.268 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 82' ' ' SER . 48.3 mttm -133.1 -31.75 1.25 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 117.589 -1.196 . . . . 0.0 111.949 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.86 165.82 31.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.833 1.197 . . . . 0.0 111.352 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.1 mt -138.08 135.63 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.8 mt -136.03 149.15 48.69 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 58.3 mt -138.75 125.27 24.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.9 mt -127.41 147.05 50.28 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 123.967 0.907 . . . . 0.0 108.964 -169.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -65.68 169.12 6.69 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -68.31 -15.13 63.45 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.626 1.17 . . . . 0.0 110.856 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -76.75 -7.2 54.93 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.062 -1.024 . . . . 0.0 112.06 171.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.18 51.16 29.14 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -169.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -130.32 136.35 49.04 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.578 1.151 . . . . 0.0 109.067 -173.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -60.59 124.28 19.9 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.211 0.605 . . . . 0.0 110.147 -174.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.1 mt -102.48 -41.19 6.38 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 158.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -145.25 151.13 37.9 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.746 0.818 . . . . 0.0 109.413 172.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.99 144.48 13.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.913 0.885 . . . . 0.0 108.69 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -149.7 149.76 31.08 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.869 0.868 . . . . 0.0 108.854 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -135.21 144.27 46.85 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 126.093 1.757 . . . . 0.0 106.786 -174.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -132.85 -8.94 3.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.785 -170.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.33 20.98 7.34 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.248 0.931 . . . . 0.0 112.87 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.2 t70 63.83 12.77 7.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.281 1.832 . . . . 0.0 113.602 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 p -62.84 -44.35 96.38 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.886 1.274 . . . . 0.0 110.555 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -141.0 83.69 13.77 Favored Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 106.409 -1.701 . . . . 0.0 106.409 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -92.5 0.03 3.95 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.667 2.244 . . . . 0.0 113.625 -170.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.0 m -136.24 139.39 42.7 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.195 0.998 . . . . 0.0 109.062 -169.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.7 t -43.83 -53.78 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 126.17 1.788 . . . . 0.0 112.845 -169.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -62.26 -44.21 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.572 0.624 . . . . 0.0 111.05 -173.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.38 -36.12 78.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -64.0 -50.35 68.87 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -56.7 -37.33 70.77 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.47 -0.769 . . . . 0.0 110.954 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.58 -44.82 77.25 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.866 0.466 . . . . 0.0 109.966 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.19 -36.95 83.46 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.4 -0.333 . . . . 0.0 110.645 175.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -65.18 -39.13 92.48 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.558 1.543 . . . . 0.0 111.231 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -64.5 -44.48 90.82 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.474 -0.766 . . . . 0.0 109.919 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.03 -48.15 76.51 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.083 -0.484 . . . . 0.0 110.571 174.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -55.11 -53.93 29.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 124.771 1.228 . . . . 0.0 108.714 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -64.82 -45.96 83.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.088 0.404 . . . . 0.0 110.588 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.44 -44.62 92.9 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 121.938 -0.476 . . . . 0.0 111.315 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtm -64.83 -50.6 66.05 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.4 p -70.84 -30.08 66.4 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.427 -0.796 . . . . 0.0 112.495 -169.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.65 -14.23 60.79 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.73 1.15 . . . . 0.0 113.36 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.43 9.09 21.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.229 1.012 . . . . 0.0 112.321 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.2 m -111.62 157.6 20.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.431 1.092 . . . . 0.0 109.013 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -80.19 30.45 0.27 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.616 1.566 . . . . 0.0 112.971 -170.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.4 m 65.07 -176.8 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.338 1.855 . . . . 0.0 113.635 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.311 10.4 pt-20 56.57 -45.45 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 131.581 3.952 . . . . 0.0 116.84 -176.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.0 tt -154.07 152.49 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 120.626 1.557 . . . . 0.0 110.084 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.08 177.58 9.76 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.81 1.644 . . . . 0.0 108.422 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.5 tt -141.87 122.16 13.94 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 170.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.54 140.77 29.04 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.286 1.034 . . . . 0.0 109.878 -169.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 51.18 28.1 3.88 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.943 1.297 . . . . 0.0 112.215 -176.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.4 -3.27 87.23 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 125.205 1.383 . . . . 0.0 113.816 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.7 mt -106.57 135.26 48.39 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 119.395 1.598 . . . . 0.0 109.226 -174.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 m -73.58 141.46 46.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 173.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.5 p -141.05 137.2 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.702 -0.624 . . . . 0.0 109.699 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.44 148.11 11.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 105.512 -2.032 . . . . 0.0 105.512 169.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 29.2 p90 -155.81 163.79 39.37 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.046 0.451 . . . . 0.0 111.377 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.86 175.89 11.23 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -140.67 142.14 34.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 m -146.16 141.38 27.43 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.832 0.853 . . . . 0.0 109.016 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.4 mp 54.43 -83.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.735 2.014 . . . . 0.0 110.829 -173.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -152.63 28.52 0.55 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.393 1.877 . . . . 0.0 109.482 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.5 tp -132.85 147.37 52.3 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.967 1.707 . . . . 0.0 109.121 -169.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -125.34 141.27 52.17 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -134.49 143.54 47.53 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.865 1.266 . . . . 0.0 108.582 -170.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -147.2 145.61 29.55 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.185 0.994 . . . . 0.0 110.933 -169.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 94.0 t -135.81 129.49 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 169.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -122.04 138.07 53.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 -169.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.66 -175.33 24.86 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 122.287 0.937 . . . . 0.0 112.211 -177.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.411 ' HA ' ' HE2' ' A' ' 14' ' ' LYS . 37.3 m -59.8 159.01 9.47 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.362 1.465 . . . . 0.0 112.28 -173.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.81 25.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 127.483 2.313 . . . . 0.0 112.599 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -73.07 -179.67 3.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.954 1.302 . . . . 0.0 112.495 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -113.61 29.98 7.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.513 1.525 . . . . 0.0 113.066 -169.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.445 ' C ' ' H ' ' A' ' 88' ' ' LEU . 2.7 p30 -128.41 -39.51 1.67 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 116.563 -1.684 . . . . 0.0 113.592 169.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.251 8.6 pm0 49.79 -16.73 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 128.36 2.664 . . . . 0.0 117.441 -173.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 86' ' ' ASN . 35.5 mt -58.98 -34.23 71.59 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 127.213 2.205 . . . . 0.0 110.893 177.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -65.57 -34.09 77.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.257 0.935 . . . . 0.0 111.738 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.0 mt -68.46 -46.88 68.6 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -53.18 -42.95 66.72 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.17 0.988 . . . . 0.0 109.958 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.33 -50.23 68.59 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.379 1.472 . . . . 0.0 110.265 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.67 -42.92 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 118.651 0.659 . . . . 0.0 110.168 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.76 -49.49 76.2 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.753 0.706 . . . . 0.0 110.488 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.06 -43.69 98.5 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.098 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.7 m -61.07 -46.1 92.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.529 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 tp -65.56 -46.4 79.64 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 119.756 1.162 . . . . 0.0 110.982 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -64.06 -42.82 96.88 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.031 0.443 . . . . 0.0 110.771 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -68.57 -38.81 81.04 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.536 -0.728 . . . . 0.0 110.959 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.1 m -60.9 -48.96 79.43 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.261 0.624 . . . . 0.0 110.666 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.7 mt -50.92 -49.29 59.93 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.844 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -68.23 -53.78 22.3 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.668 1.122 . . . . 0.0 111.032 178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 13.4 ptt? -70.63 -30.18 66.75 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.613 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.9 mt -75.99 -43.06 46.23 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.59 0.632 . . . . 0.0 112.171 174.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 51.54 36.22 16.49 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.505 1.122 . . . . 0.0 110.793 -169.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -150.05 170.9 17.8 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 127.074 2.149 . . . . 0.0 107.045 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -57.55 132.68 53.92 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.262 0.625 . . . . 0.0 109.799 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.9 m -89.37 42.08 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 124.579 1.152 . . . . 0.0 111.115 -169.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.6 178.02 1.09 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.619 1.168 . . . . 0.0 112.113 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -46.41 -54.63 8.75 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.455 1.102 . . . . 0.0 111.778 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -63.27 -42.15 99.11 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.715 0.234 . . . . 0.0 111.614 -176.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.312 0.0 OUTLIER -79.55 -31.98 42.08 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.409 -1.432 . . . . 0.0 111.254 175.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.99 -41.72 92.68 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.815 0.734 . . . . 0.0 111.269 170.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -74.48 -10.62 59.74 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.592 -0.693 . . . . 0.0 112.607 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.96 27.32 4.9 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.472 1.109 . . . . 0.0 112.878 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.1 mmt -43.17 -43.9 4.85 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.741 1.216 . . . . 0.0 112.723 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -63.81 -42.22 97.72 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.203 0.91 . . . . 0.0 111.211 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.3 96.4 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 tp -55.61 -51.9 65.61 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.844 1.257 . . . . 0.0 110.219 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -57.43 -47.32 82.1 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.013 0.525 . . . . 0.0 109.613 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 69.5 mt -65.0 -39.22 93.13 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.091 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.97 -44.33 89.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.843 0.747 . . . . 0.0 110.563 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 39.9 t -56.28 -48.24 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.53 6.8 0.98 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.52 1.528 . . . . 0.0 113.57 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -126.16 -23.28 3.91 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.743 1.617 . . . . 0.0 110.682 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 48.0 mt -84.35 -37.78 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.9 159.35 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 119.797 1.181 . . . . 0.0 111.239 -172.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -159.99 138.03 10.08 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.482 1.513 . . . . 0.0 108.366 169.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.59 26.53 57.3 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-O 119.434 -0.648 . . . . 0.0 114.464 171.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.49 13.77 75.28 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-N 118.215 1.007 . . . . 0.0 113.13 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 t -128.84 141.46 46.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 29.8 pt -64.16 158.95 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.734 0.778 . . . . 0.0 110.071 170.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.7 mt -116.98 -39.9 3.19 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.714 1.606 . . . . 0.0 108.769 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -155.68 160.97 40.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.624 1.169 . . . . 0.0 108.419 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.5 p -138.03 37.88 2.35 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.658 1.583 . . . . 0.0 109.799 -173.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -136.1 120.13 12.75 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.48 -34.11 6.14 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.355 2.037 . . . . 0.0 112.149 -170.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -67.23 -45.66 76.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -65.73 -38.73 89.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.668 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 5.0 t -56.48 -53.58 38.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 119.141 0.882 . . . . 0.0 109.895 173.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 70.7 t -64.57 -36.49 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.725 1.148 . . . . 0.0 110.372 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.32 -50.81 72.29 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.989 0.813 . . . . 0.0 110.239 174.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.1 mtt-85 -59.54 -43.46 93.51 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 111.102 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 51.1 t -59.0 -43.6 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.624 1.102 . . . . 0.0 110.048 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.2 -32.66 70.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.024 0.53 . . . . 0.0 111.691 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.9 tp -73.49 -28.65 62.04 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.268 1.827 . . . . 0.0 112.268 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 123.735 0.814 . . . . 0.0 109.891 175.643 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -140.76 163.41 32.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.502 1.521 . . . . 0.0 107.715 176.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.39 140.18 58.85 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 123.207 0.603 . . . . 0.0 109.527 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.38 -39.12 59.55 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.9 mt -79.87 62.49 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 169.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.8 tp -60.07 -27.06 66.66 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.967 0.907 . . . . 0.0 112.072 -172.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.54 108.43 13.28 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 171.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.88 153.37 68.47 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.408 2.072 . . . . 0.0 112.019 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.0 m -73.52 -5.12 38.12 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.804 1.241 . . . . 0.0 112.691 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -147.44 177.9 8.86 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.776 1.63 . . . . 0.0 109.778 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -37.7 126.44 1.15 Allowed 'General case' 0 C--O 1.235 0.293 0 C-N-CA 128.159 2.584 . . . . 0.0 115.09 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 m -71.94 -38.75 69.76 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 168.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -141.78 135.26 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 126.452 1.901 . . . . 0.0 106.555 175.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -92.55 -36.66 12.91 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 0.0 110.736 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.67 167.29 28.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.996 0.816 . . . . 0.0 111.947 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.3 mt -135.33 135.4 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 104.893 -2.262 . . . . 0.0 104.893 171.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.6 mt -133.02 148.68 52.24 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 57.5 mt -136.78 113.18 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 102.763 -3.051 . . . . 0.0 102.763 169.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.2 mt -122.06 146.95 46.7 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.401 0.68 . . . . 0.0 109.678 -169.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.41 169.81 5.53 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 168.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -14.87 59.75 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.38 1.072 . . . . 0.0 112.413 173.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -75.22 -9.33 58.45 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.193 0.997 . . . . 0.0 112.139 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.83 51.47 15.09 Favored Glycine 0 C--N 1.339 0.737 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -140.06 133.45 29.97 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.259 1.023 . . . . 0.0 108.684 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 124.84 22.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.279 0.491 . . . . 0.0 111.609 -170.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.8 mt -82.45 -37.42 25.44 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 153.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -145.55 151.97 38.98 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.055 1.342 . . . . 0.0 108.853 170.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -154.7 147.57 24.49 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -138.34 135.16 35.1 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 171.429 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -123.54 129.77 51.68 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -103.66 -24.51 13.36 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -55.07 158.46 2.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.086 2.554 . . . . 0.0 112.575 169.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -119.52 1.39 11.16 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.795 1.638 . . . . 0.0 111.867 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 m -75.81 -35.25 60.08 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.792 1.237 . . . . 0.0 110.084 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -130.15 67.91 80.37 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 125.287 1.435 . . . . 0.0 108.784 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -89.14 -1.38 6.21 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.814 2.343 . . . . 0.0 113.713 -173.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 m -137.63 148.92 46.2 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.894 0.878 . . . . 0.0 110.313 -169.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.7 t -45.54 -53.61 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 126.327 1.851 . . . . 0.0 112.733 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -54.61 -47.94 72.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 118.593 0.633 . . . . 0.0 111.064 -175.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -75.47 -34.16 60.88 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 -176.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -63.07 -46.81 85.7 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.815 0.846 . . . . 0.0 110.625 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -63.86 -34.24 77.49 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.281 0.946 . . . . 0.0 111.068 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -47.22 78.33 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.903 -0.498 . . . . 0.0 109.897 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -61.6 -40.02 93.3 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.95 0.9 . . . . 0.0 110.805 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -57.41 -49.9 74.74 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.654 1.581 . . . . 0.0 111.168 172.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -62.4 -40.96 98.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.808 1.186 . . . . 0.0 110.53 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -48.46 77.96 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.028 0.531 . . . . 0.0 110.641 173.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.6 mt -60.85 -48.05 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.08 0 C-N-CA 123.712 0.805 . . . . 0.0 109.481 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -58.84 -45.91 88.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.484 0.714 . . . . 0.0 110.158 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -63.02 -42.13 99.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.857 0.463 . . . . 0.0 112.066 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -68.86 -50.46 49.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.885 0.474 . . . . 0.0 110.471 -177.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.5 p -61.55 -35.15 76.96 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 123.733 0.813 . . . . 0.0 112.89 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.45 0.3 3.11 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -119.93 33.48 5.6 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.307 1.443 . . . . 0.0 109.761 -171.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.4 p -135.97 -174.4 3.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.069 0.948 . . . . 0.0 111.116 -169.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -78.63 6.02 9.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.77 1.228 . . . . 0.0 111.814 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m 68.79 31.25 4.51 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.264 1.826 . . . . 0.0 115.347 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.46 -16.69 4.31 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.917 0.487 . . . . 0.0 111.154 169.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.1 tt -164.74 156.28 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.361 1.064 . . . . 0.0 109.127 -171.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.82 171.81 14.62 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.351 1.861 . . . . 0.0 108.965 170.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -131.94 116.76 17.56 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.5 mt -78.15 -128.49 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.18 1.392 . . . . 0.0 108.535 -175.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -82.16 2.47 31.38 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.127 -0.983 . . . . 0.0 111.698 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.16 -33.29 0.51 Allowed Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.951 1.739 . . . . 0.0 110.474 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.0 mt -67.06 155.42 38.73 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.836 0.854 . . . . 0.0 109.423 173.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 55.8 m -112.45 145.2 40.6 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -138.56 130.32 37.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.0 m -97.45 146.04 8.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -156.49 167.14 31.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.124 0.42 . . . . 0.0 111.021 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -155.19 178.59 10.03 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.616 1.166 . . . . 0.0 108.103 169.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.1 p -142.42 148.59 38.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.91 0.484 . . . . 0.0 109.847 170.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.1 m -146.74 143.21 28.53 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.833 1.253 . . . . 0.0 108.936 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.2 mp 52.5 -87.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.507 1.923 . . . . 0.0 111.141 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -144.9 16.86 1.59 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.589 1.956 . . . . 0.0 109.76 -178.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 23.4 tp -120.22 144.07 47.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.971 2.108 . . . . 0.0 108.397 -169.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -122.55 146.02 47.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -135.51 137.47 42.14 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 -171.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -146.66 150.64 35.82 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.883 0.873 . . . . 0.0 110.529 -171.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 83.9 t -140.39 129.75 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.53 144.13 27.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -162.2 -175.76 33.57 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 121.814 0.674 . . . . 0.0 112.203 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 155.31 23.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.192 1.397 . . . . 0.0 111.343 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -56.23 -46.61 79.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.189 0.996 . . . . 0.0 110.677 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 15.0 t80 51.07 -169.83 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.204 2.202 . . . . 0.0 112.935 173.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -82.72 -18.29 41.34 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.356 -0.84 . . . . 0.0 111.405 175.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -157.49 176.94 12.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 125.478 1.511 . . . . 0.0 109.662 -175.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.79 4.18 8.13 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.119 2.167 . . . . 0.0 110.512 -174.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.8 mt -69.63 -32.4 71.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.558 1.143 . . . . 0.0 111.093 -173.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -34.16 77.53 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.248 0.931 . . . . 0.0 111.149 173.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.1 mt -66.76 -48.3 69.52 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.8 mmt -54.34 -42.85 70.71 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.029 0.531 . . . . 0.0 110.335 174.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.6 84.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.707 0.803 . . . . 0.0 110.502 -177.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.72 -43.67 96.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.062 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.9 tp -61.2 -49.15 78.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.131 0.878 . . . . 0.0 110.417 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -63.48 -42.91 98.55 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.306 -178.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.56 -51.89 67.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.66 -47.52 83.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.439 0.563 . . . . 0.0 110.26 -176.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -65.4 -40.16 93.06 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.976 0.353 . . . . 0.0 111.497 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -71.72 -32.87 68.23 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.266 -0.896 . . . . 0.0 111.191 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -61.06 -49.89 75.5 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.685 0.794 . . . . 0.0 110.268 174.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.8 mt -52.44 -51.24 60.23 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -59.05 -19.68 46.32 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -84.78 -55.08 4.28 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 120.637 1.562 . . . . 0.0 110.44 171.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 23.0 ptt? -78.11 -7.44 57.0 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -171.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 30.0 tp -144.68 59.35 1.32 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 127.291 2.236 . . . . 0.0 106.124 -171.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -52.55 -17.69 1.37 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.092 . . . . 0.0 114.929 -170.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -66.14 -166.15 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.45 1.023 . . . . 0.0 111.217 170.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -76.8 9.13 3.05 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.257 24.0 m 42.76 41.69 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 125.84 1.656 . . . . 0.0 112.914 -175.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -75.52 176.16 7.84 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.262 1.025 . . . . 0.0 111.184 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -49.85 -49.59 48.62 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.133 0.973 . . . . 0.0 112.972 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -62.9 -40.37 97.36 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.037 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.19 94.24 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.509 0.595 . . . . 0.0 110.305 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -59.78 -49.76 76.45 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.874 0.87 . . . . 0.0 110.107 175.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.33 -40.43 74.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.693 1.197 . . . . 0.0 110.98 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.87 -14.12 62.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.822 0.849 . . . . 0.0 113.086 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -133.72 22.38 3.93 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.919 0.887 . . . . 0.0 112.284 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.3 mmt -45.6 -45.37 13.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.301 1.44 . . . . 0.0 111.872 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.85 -40.29 94.92 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.433 1.015 . . . . 0.0 111.7 -177.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.0 -42.23 94.81 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 177.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 tp -57.09 -51.26 69.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.235 1.014 . . . . 0.0 110.493 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -55.5 -46.86 76.92 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.337 0.655 . . . . 0.0 109.286 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.57 -41.83 96.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.893 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -59.82 -45.35 92.66 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.613 1.097 . . . . 0.0 110.496 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.26 -42.71 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.616 0.644 . . . . 0.0 109.831 175.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -66.17 -26.34 67.37 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.376 0.67 . . . . 0.0 112.804 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -79.47 -34.67 41.23 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.163 0.892 . . . . 0.0 110.892 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 81.4 mt -79.56 -40.36 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.015 -174.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.6 t -133.9 145.56 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.302 0.955 . . . . 0.0 110.166 -169.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -146.16 131.92 19.0 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.415 1.486 . . . . 0.0 107.456 169.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.56 25.1 54.73 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 123.555 0.598 . . . . 0.0 113.705 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.09 22.92 78.65 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.241 1.02 . . . . 0.0 113.387 -177.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 58.5 t -128.73 140.43 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 176.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.0 pt -69.08 159.36 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-O 121.377 0.608 . . . . 0.0 110.395 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.8 mt -121.71 -34.2 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.136 1.375 . . . . 0.0 109.512 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -156.09 158.18 37.29 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.743 1.217 . . . . 0.0 108.477 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.5 m -135.5 -3.81 2.35 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.664 1.585 . . . . 0.0 111.627 177.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -77.26 116.34 56.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 119.316 0.962 . . . . 0.0 108.743 169.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.65 -33.91 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.563 2.176 . . . . 0.0 112.109 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -68.04 -44.41 76.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -68.36 -34.57 76.31 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.171 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.76 -51.6 68.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 119.182 0.901 . . . . 0.0 109.587 170.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 63.8 t -63.19 -36.92 77.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.768 1.167 . . . . 0.0 110.613 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -46.84 87.95 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.197 0.908 . . . . 0.0 110.154 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 48.0 mtp180 -60.01 -44.51 94.54 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.089 175.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 78.1 t -58.48 -46.33 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 119.697 1.135 . . . . 0.0 109.707 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.53 -33.11 74.4 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.358 0.663 . . . . 0.0 111.663 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 64.7 tp -71.35 -31.42 67.32 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.93 1.692 . . . . 0.0 111.644 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.947 175.651 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ptt? . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.76 0.314 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -149.25 165.36 32.12 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.103 1.361 . . . . 0.0 107.988 175.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -153.23 0.5 0.25 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.199 1.4 . . . . 0.0 113.23 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 61.6 tp -139.3 -37.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.528 1.131 . . . . 0.0 110.674 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -120.34 53.56 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.6 mt -64.33 163.43 13.04 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 168.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -50.17 120.26 11.7 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.923 0.889 . . . . 0.0 109.361 179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.35 147.41 41.67 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.165 1.91 . . . . 0.0 111.931 -169.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -136.79 39.82 2.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.568 1.947 . . . . 0.0 107.596 172.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.6 pp -144.14 -174.21 4.22 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.467 1.907 . . . . 0.0 109.947 -169.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -132.62 142.46 49.13 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.024 1.33 . . . . 0.0 108.003 -172.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -68.33 -31.08 70.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.428 0.558 . . . . 0.0 109.622 176.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.49 125.97 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 169.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -81.05 -32.18 34.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 117.986 -1.007 . . . . 0.0 109.091 171.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.56 168.15 26.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.961 0.8 . . . . 0.0 111.735 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.9 mt -136.65 138.02 46.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 104.303 -2.48 . . . . 0.0 104.303 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mt -137.0 151.0 48.47 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -138.19 120.2 18.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 103.343 -2.836 . . . . 0.0 103.343 169.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.7 mt -126.05 147.0 49.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.45 169.41 6.01 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.181 0.515 . . . . 0.0 110.845 171.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -9.66 0.65 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 116.572 2.064 . . . . 0.0 116.572 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -119.95 9.37 11.24 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.145 1.378 . . . . 0.0 110.586 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.24 19.6 54.83 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.635 1.112 . . . . 0.0 112.469 173.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.4 133.28 39.94 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.358 1.579 . . . . 0.0 109.671 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -55.89 126.02 23.9 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.111 0.965 . . . . 0.0 108.98 176.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.3 mt -116.81 -45.73 2.77 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 165.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -143.83 152.69 41.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.54 148.63 19.76 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -141.7 136.12 30.52 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 171.075 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -125.73 146.82 49.59 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -130.61 -34.11 1.58 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.914 0.886 . . . . 0.0 111.329 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -78.93 159.59 27.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 172.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -78.53 7.79 6.19 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.935 1.694 . . . . 0.0 111.95 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 p -64.69 -45.99 84.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.244 1.418 . . . . 0.0 111.42 -177.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.9 70.88 29.5 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.338 1.055 . . . . 0.0 109.213 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -86.26 -1.46 8.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.573 2.182 . . . . 0.0 113.538 -173.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.8 m -134.52 138.35 44.59 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.126 0.97 . . . . 0.0 109.684 -169.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.0 t -46.31 -49.05 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.299 1.839 . . . . 0.0 112.937 -169.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -57.15 -46.57 82.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.383 0.538 . . . . 0.0 110.816 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.27 -32.07 60.93 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.286 -0.259 . . . . 0.0 110.349 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -62.72 -51.25 67.92 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 122.941 0.496 . . . . 0.0 110.203 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -59.64 -34.29 72.61 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.566 -0.708 . . . . 0.0 110.764 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.1 -47.28 74.72 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.745 0.418 . . . . 0.0 109.954 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -61.14 -36.63 80.29 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.829 0.451 . . . . 0.0 110.916 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -65.77 -40.94 92.51 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.17 1.388 . . . . 0.0 111.276 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -66.68 -39.24 88.04 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.245 0.93 . . . . 0.0 110.109 173.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -48.74 76.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.992 0.517 . . . . 0.0 110.622 171.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -56.74 -54.6 27.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.109 0 C-N-CA 124.475 1.11 . . . . 0.0 108.513 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -58.72 -48.78 79.97 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.328 0.651 . . . . 0.0 110.208 -176.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -60.74 -45.13 95.48 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.319 0.648 . . . . 0.0 111.894 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -70.02 -48.9 56.14 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 34.5 p -67.5 -28.18 67.62 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.591 -0.693 . . . . 0.0 112.088 -174.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.34 -18.76 60.19 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 118.796 0.725 . . . . 0.0 111.896 174.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtt-85 -113.76 19.22 16.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.751 1.62 . . . . 0.0 110.482 -172.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.3 m -131.49 154.44 48.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.759 1.224 . . . . 0.0 109.07 -169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.79 88.73 4.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.31 1.044 . . . . 0.0 109.306 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.9 m -46.66 136.95 7.35 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 126.171 1.788 . . . . 0.0 115.808 -169.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.74 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 1 C-N-CA 133.031 4.533 . . . . 0.0 107.75 172.093 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 tt -153.43 158.92 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.386 1.474 . . . . 0.0 108.569 178.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.34 165.04 34.28 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.72 2.008 . . . . 0.0 108.778 173.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -131.21 104.32 6.99 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 102.16 -3.274 . . . . 0.0 102.16 170.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -76.65 -64.87 1.02 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -168.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -141.77 6.55 1.83 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.837 1.655 . . . . 0.0 110.617 -173.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.4 -39.13 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 126.442 1.972 . . . . 0.0 109.169 -173.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.6 mt -72.98 132.98 44.11 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.406 0.682 . . . . 0.0 109.869 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.2 m -83.41 142.91 30.65 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.8 t -135.67 138.13 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.15 133.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.6 p90 -156.73 164.31 38.27 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -169.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -152.33 177.47 10.54 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.698 1.199 . . . . 0.0 108.989 172.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.0 p -143.66 147.87 34.94 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.255 0.622 . . . . 0.0 109.38 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.0 m -146.97 137.99 23.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.483 1.113 . . . . 0.0 108.894 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 mp 53.16 -84.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 127.483 2.313 . . . . 0.0 112.551 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -143.92 23.29 1.73 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.795 1.638 . . . . 0.0 109.552 -176.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 tp -132.04 145.35 51.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.63 1.572 . . . . 0.0 109.152 -169.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -125.85 146.11 49.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.41 138.45 46.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -144.3 148.81 35.29 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 123.568 0.747 . . . . 0.0 110.109 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -134.44 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 104.432 -2.433 . . . . 0.0 104.432 170.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.27 134.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -173.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -156.98 177.08 34.05 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-O 122.398 0.999 . . . . 0.0 113.172 -177.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.3 m -63.68 164.36 9.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 112.867 -1.666 . . . . 0.0 109.5 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -128.09 28.23 5.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.943 0.897 . . . . 0.0 110.597 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -60.37 -40.91 92.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.738 0.815 . . . . 0.0 112.968 -169.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -156.19 -23.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -145.9 165.77 27.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.339 0.972 . . . . 0.0 111.634 -171.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.8 -7.55 5.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.327 2.651 . . . . 0.0 110.326 177.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.66 -33.27 72.56 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.664 1.186 . . . . 0.0 110.775 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -64.09 -34.28 77.69 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.135 0.88 . . . . 0.0 111.819 174.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.22 -42.02 63.11 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.9 mmt -58.2 -40.75 82.37 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.521 171.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.06 -50.13 71.83 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.827 0.851 . . . . 0.0 109.815 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.42 -45.07 99.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 118.918 -0.563 . . . . 0.0 109.94 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 39.3 tp -60.47 -48.89 79.8 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.475 0.579 . . . . 0.0 110.304 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.46 -44.87 93.22 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.381 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 87.7 m -62.78 -43.85 97.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.523 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.9 tp -64.68 -51.73 60.93 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.785 0.72 . . . . 0.0 110.158 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -61.31 -42.04 97.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.396 0.278 . . . . 0.0 110.701 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.98 -38.56 66.62 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.593 -0.692 . . . . 0.0 111.483 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 m -61.51 -43.89 98.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.133 0.879 . . . . 0.0 110.379 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 mt -57.71 -45.76 85.31 Favored 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.2 m -61.4 -26.4 67.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.829 -0.605 . . . . 0.0 112.235 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -75.34 -53.13 9.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.819 1.19 . . . . 0.0 110.365 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 3.0 ptp -69.85 -39.42 76.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.012 0.824 . . . . 0.0 112.076 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.27 -37.82 60.76 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.532 0.606 . . . . 0.0 110.172 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 48.11 33.53 3.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.47 1.508 . . . . 0.0 113.028 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -153.31 -172.21 4.16 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.92 2.088 . . . . 0.0 107.421 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -50.0 122.9 7.26 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.804 0.842 . . . . 0.0 109.322 173.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 m -78.03 40.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 C-N-CA 125.029 1.332 . . . . 0.0 110.251 170.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.19 172.56 12.64 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.673 1.189 . . . . 0.0 112.231 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -43.77 -60.23 1.89 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.981 2.112 . . . . 0.0 112.874 -177.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -63.11 -46.11 88.87 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.726 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.71 82.08 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.943 0.792 . . . . 0.0 111.405 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.3 mp -74.14 -36.21 64.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.978 175.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.3 tp -58.63 -37.19 75.39 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.162 0.892 . . . . 0.0 110.956 171.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -73.9 -15.42 61.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 175.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -124.58 25.87 7.41 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.581 1.082 . . . . 0.0 111.454 -173.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.32 -48.63 18.25 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.908 1.283 . . . . 0.0 112.007 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.98 -39.51 94.3 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.721 0.691 . . . . 0.0 111.343 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.97 96.74 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.03 -50.6 72.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.609 1.163 . . . . 0.0 110.357 174.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -55.41 -48.07 74.93 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.028 0.531 . . . . 0.0 109.816 178.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.9 mt -65.56 -37.8 87.73 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.17 0.588 . . . . 0.0 111.397 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.37 -47.08 83.58 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 118.872 0.76 . . . . 0.0 109.906 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.95 -46.21 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.3 -2.92 4.92 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.125 1.37 . . . . 0.0 113.804 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -117.16 -12.94 10.52 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.749 1.22 . . . . 0.0 112.005 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 59.8 mt -87.9 -40.39 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.278 0.945 . . . . 0.0 108.503 173.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.32 156.24 21.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 124.936 1.294 . . . . 0.0 109.901 -172.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -149.8 136.44 19.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.252 1.421 . . . . 0.0 107.217 169.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.97 29.07 50.62 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 119.242 -0.755 . . . . 0.0 113.182 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.08 10.67 85.28 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 118.299 1.049 . . . . 0.0 113.835 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.12 133.33 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-N 119.079 1.439 . . . . 0.0 107.265 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.1 pt -57.77 145.15 9.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.085 0.554 . . . . 0.0 110.393 173.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -133.81 -14.22 2.46 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.202 1.001 . . . . 0.0 112.018 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -149.86 159.88 44.02 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.9 m -150.69 41.81 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.874 1.27 . . . . 0.0 109.464 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -139.94 119.86 9.05 Favored Pre-proline 0 C--O 1.235 0.325 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 173.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -30.82 13.18 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.056 1.837 . . . . 0.0 112.114 -169.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.18 -41.47 85.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -68.27 -42.1 80.08 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.473 0.579 . . . . 0.0 109.685 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 28.6 t -55.96 -55.8 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 118.845 -0.597 . . . . 0.0 109.471 176.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 5.2 p -65.26 -33.16 61.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 119.604 1.093 . . . . 0.0 110.798 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -60.59 -44.32 96.38 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.177 0.899 . . . . 0.0 110.566 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -63.57 -42.65 98.3 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.469 -0.769 . . . . 0.0 110.935 175.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.1 t -58.18 -42.2 82.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.968 0.804 . . . . 0.0 109.745 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.11 77.46 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.578 0.751 . . . . 0.0 111.902 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.94 -39.22 79.68 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.479 0.711 . . . . 0.0 111.386 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 54.9 mtp180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.427 -176.487 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 tmt? . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -147.88 155.63 41.82 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 174.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -135.7 -11.49 2.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.059 1.344 . . . . 0.0 113.072 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -147.98 155.3 41.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.521 1.055 . . . . 0.0 109.512 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.4 mm 46.6 41.09 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.308 1.443 . . . . 0.0 109.76 -171.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 69.1 tp -58.99 -34.2 71.57 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.565 0.746 . . . . 0.0 109.53 171.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -136.82 157.46 74.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 127.209 2.203 . . . . 0.0 106.027 169.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.53 38.21 0.55 Allowed 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 112.293 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 m -55.23 -42.73 73.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 0.0 110.026 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.1 tp -79.34 114.89 18.63 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 104.403 -2.443 . . . . 0.0 104.403 168.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -51.6 131.9 30.04 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.761 0.824 . . . . 0.0 111.904 -169.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.6 m -58.1 -35.56 71.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.699 1.599 . . . . 0.0 110.649 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -155.24 151.34 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -117.27 -30.42 5.6 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 117.585 -1.198 . . . . 0.0 111.747 -173.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.58 166.6 26.71 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 119.837 1.199 . . . . 0.0 111.656 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.1 mt -137.03 136.45 47.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -133.3 148.22 51.91 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.7 mt -139.06 118.18 13.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 169.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.4 mt -122.68 146.71 47.23 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -173.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 168.81 8.16 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.219 0.533 . . . . 0.0 110.31 169.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -12.23 1.54 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -115.97 3.64 13.69 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.94 1.296 . . . . 0.0 110.919 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.99 5.23 55.06 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.073 1.32 . . . . 0.0 113.084 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -69.8 133.76 47.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.426 1.613 . . . . 0.0 109.89 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -61.15 123.87 18.94 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 118.504 0.593 . . . . 0.0 109.653 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -100.08 -40.86 7.4 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 162.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -150.09 152.93 35.55 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.458 172.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.17 146.84 19.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 168.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.452 ' HE2' ' H ' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -147.46 146.78 29.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 170.437 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.452 ' H ' ' HE2' ' A' ' 29' ' ' LYS . 79.7 m-85 -133.6 151.72 51.75 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.969 1.708 . . . . 0.0 106.662 -177.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -135.92 1.4 2.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.869 0.868 . . . . 0.0 111.887 -175.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -133.68 158.31 43.59 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.737 0.815 . . . . 0.0 109.447 -176.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.52 5.19 3.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.358 2.263 . . . . 0.0 112.609 -173.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 p -62.21 -50.09 73.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.645 1.178 . . . . 0.0 110.532 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -142.68 64.71 15.84 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 124.193 0.997 . . . . 0.0 109.992 -174.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -82.18 -2.02 11.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.778 2.319 . . . . 0.0 113.598 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.5 m -138.01 143.68 40.71 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.914 0.886 . . . . 0.0 110.287 -169.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.8 t -45.62 -51.3 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 126.491 1.916 . . . . 0.0 113.127 -169.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -58.67 -46.64 86.75 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.799 0.727 . . . . 0.0 110.893 -176.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -70.37 -34.48 72.65 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.639 0.376 . . . . 0.0 110.165 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -63.2 -52.04 63.87 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.231 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -60.18 -35.35 75.17 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.894 0.77 . . . . 0.0 111.348 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.15 -49.92 70.24 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -63.4 -39.47 94.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.589 0.355 . . . . 0.0 111.023 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.07 -40.55 98.03 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.927 1.691 . . . . 0.0 111.564 178.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -69.32 -40.96 77.32 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.648 -0.657 . . . . 0.0 110.001 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.12 -48.78 73.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.979 0.512 . . . . 0.0 110.557 171.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.9 mm -54.86 -59.92 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 C-N-CA 125.133 1.373 . . . . 0.0 108.092 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -57.65 -45.33 85.62 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.629 0.772 . . . . 0.0 111.323 -172.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -57.84 -52.92 63.5 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 122.687 0.395 . . . . 0.0 110.507 176.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -63.9 -45.83 87.57 Favored 'General case' 0 C--O 1.23 0.062 0 CA-C-O 119.431 -0.318 . . . . 0.0 110.191 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.2 p -68.27 -32.06 71.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 119.205 0.911 . . . . 0.0 111.996 -172.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -73.51 0.55 12.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.442 1.019 . . . . 0.0 112.981 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -136.92 35.42 2.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.948 1.299 . . . . 0.0 110.451 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.3 m -135.88 156.98 47.95 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.387 1.875 . . . . 0.0 108.14 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -80.17 86.09 5.64 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.327 1.051 . . . . 0.0 109.055 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.7 m -50.57 144.27 8.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -169.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 145.45 -42.84 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 1 C-N-CA 133.553 4.741 . . . . 0.0 105.823 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -157.35 160.15 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.748 1.219 . . . . 0.0 108.973 -178.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.23 174.57 15.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.894 1.678 . . . . 0.0 110.207 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -136.7 116.89 13.46 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 176.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.2 mp -127.63 117.79 22.66 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.236 1.414 . . . . 0.0 107.296 -172.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 50.68 31.49 5.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.121 1.368 . . . . 0.0 112.765 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.03 -16.03 61.59 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.859 1.218 . . . . 0.0 113.471 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.0 mt -91.21 134.15 34.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.456 1.628 . . . . 0.0 109.258 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 61.3 m -76.18 141.82 41.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 172.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.2 t -133.67 137.87 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -128.65 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 174.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -158.19 164.72 36.26 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.292 0.496 . . . . 0.0 112.218 -169.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -148.42 171.54 15.88 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.756 1.222 . . . . 0.0 108.352 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 p -145.47 143.91 30.29 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 169.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 17.1 m -147.24 142.89 27.71 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 109.665 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.4 mt 63.87 -81.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.382 1.873 . . . . 0.0 111.68 169.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -151.61 27.26 0.65 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.354 1.861 . . . . 0.0 109.151 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.2 tp -138.98 147.35 42.07 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.967 1.707 . . . . 0.0 110.062 -168.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -129.53 144.99 51.5 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.364 1.466 . . . . 0.0 107.454 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -132.85 137.19 46.63 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.433 1.493 . . . . 0.0 107.236 -172.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -146.13 151.19 37.27 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.728 0.695 . . . . 0.0 110.479 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.0 t -138.22 141.58 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 105.018 -2.215 . . . . 0.0 105.018 169.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.22 141.12 44.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 -172.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.89 -178.91 36.2 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 121.739 0.633 . . . . 0.0 113.062 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -62.57 164.8 7.04 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 113.973 -1.114 . . . . 0.0 110.205 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.1 m -124.68 43.96 2.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.866 0.866 . . . . 0.0 111.021 -169.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -71.91 -166.64 0.23 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 122.863 0.465 . . . . 0.0 110.21 169.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -58.41 -3.6 0.3 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 117.049 2.24 . . . . 0.0 117.049 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.69 167.69 25.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 120.27 1.396 . . . . 0.0 111.211 176.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.82 -0.91 2.78 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.486 2.715 . . . . 0.0 110.295 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.8 mt -63.65 -32.55 74.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.792 1.237 . . . . 0.0 109.937 -175.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -34.53 78.51 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.896 0.771 . . . . 0.0 111.355 175.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 mt -70.57 -45.19 65.87 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.5 mtp -58.94 -37.43 76.71 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.832 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.13 74.02 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.776 0.83 . . . . 0.0 110.364 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.6 t -59.05 -46.34 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.7 tp -58.05 -49.96 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.993 0.517 . . . . 0.0 110.366 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -63.6 -43.55 96.6 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 119.116 -0.469 . . . . 0.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.3 m -64.21 -42.18 96.73 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.491 0.587 . . . . 0.0 110.709 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.3 tp -67.93 -46.62 71.0 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.638 0.654 . . . . 0.0 110.241 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -62.34 -42.95 99.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.679 0.392 . . . . 0.0 111.046 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -76.58 -37.93 55.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.364 -0.835 . . . . 0.0 111.174 -176.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.7 p -63.13 -39.67 95.35 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.641 1.11 . . . . 0.0 110.442 175.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 11.6 mt -54.35 -52.64 60.96 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 m -56.21 -33.42 65.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.885 0.474 . . . . 0.0 111.928 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -69.25 -59.24 3.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.086 173.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.6 ptt? -69.6 -31.52 69.71 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.061 1.301 . . . . 0.0 113.472 -169.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.84 -35.42 74.73 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.824 0.738 . . . . 0.0 111.794 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? 49.08 33.29 4.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.424 1.09 . . . . 0.0 112.039 -171.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -155.21 175.66 13.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.076 2.151 . . . . 0.0 106.585 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -62.48 136.31 57.84 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -76.16 51.97 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.204 1.802 . . . . 0.0 111.02 -174.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.08 169.99 17.36 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.508 1.123 . . . . 0.0 111.745 -177.369 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -47.47 -55.42 9.09 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.366 1.866 . . . . 0.0 112.799 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -66.36 -38.27 87.19 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.221 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.76 -35.84 82.38 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.337 0.971 . . . . 0.0 110.864 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.99 -42.88 80.12 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 118.94 0.791 . . . . 0.0 110.685 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 58.1 tp -58.26 -37.4 74.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.667 0.667 . . . . 0.0 111.211 176.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -69.61 -18.45 63.61 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.104 0.962 . . . . 0.0 113.011 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -126.23 24.67 6.8 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.225 1.01 . . . . 0.0 111.525 -171.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -44.35 -49.34 9.6 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.475 1.51 . . . . 0.0 112.424 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.63 -42.48 98.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.205 0.911 . . . . 0.0 110.952 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.95 -43.88 98.24 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.14 -50.46 73.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.391 1.076 . . . . 0.0 110.837 175.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -55.06 -48.78 73.0 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.383 0.673 . . . . 0.0 109.871 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 97.1 mt -71.27 -32.27 68.5 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.416 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.46 -44.56 96.12 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.288 0.949 . . . . 0.0 109.71 173.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.35 -47.89 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 118.794 0.725 . . . . 0.0 109.638 174.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -61.12 -26.73 67.87 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -87.9 -28.95 21.22 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.118 0.967 . . . . 0.0 111.515 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.11 -43.35 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-N 119.089 0.859 . . . . 0.0 109.507 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 p -142.01 146.77 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.03 0.932 . . . . 0.0 110.39 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -144.49 138.93 27.95 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.02 1.328 . . . . 0.0 107.424 169.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.73 29.53 49.72 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.573 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.48 19.88 79.73 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 118.201 1.001 . . . . 0.0 113.417 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 61.3 t -130.94 133.59 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.6 pt -64.61 146.91 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.84 -12.35 3.75 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.888 0.875 . . . . 0.0 111.401 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.87 156.0 43.26 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 169.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.7 m -151.76 41.66 0.69 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.422 1.089 . . . . 0.0 109.735 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -142.36 120.5 7.44 Favored Pre-proline 0 C--O 1.235 0.299 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 174.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.81 -28.93 19.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.237 1.958 . . . . 0.0 111.775 -169.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -70.98 -39.96 72.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.78 -41.39 75.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 118.89 0.768 . . . . 0.0 109.609 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 42.1 t -55.3 -56.27 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.16 -34.6 71.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 118.979 0.809 . . . . 0.0 110.819 -174.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -59.17 -50.77 72.76 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.039 0.836 . . . . 0.0 109.904 176.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -62.05 -40.3 95.29 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.881 -0.512 . . . . 0.0 111.135 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 65.3 t -64.07 -37.48 79.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.777 0.717 . . . . 0.0 110.654 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.35 -37.71 71.67 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.755 1.162 . . . . 0.0 111.071 175.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.0 tp -70.18 -26.09 63.74 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.48 1.912 . . . . 0.0 112.698 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 C-N-CA 124.861 1.264 . . . . 0.0 112.184 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.209 0 N-CA-C 110.421 -0.214 . . . . 0.0 110.421 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.15 -14.83 57.68 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.009 1.114 . . . . 0.0 114.009 -173.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.86 -7.74 55.22 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.185 -0.947 . . . . 0.0 112.666 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.7 tp -142.08 -34.34 0.46 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.168 0.894 . . . . 0.0 112.542 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.3 mt -134.26 55.0 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -175.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.48 -36.51 73.86 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.473 0.709 . . . . 0.0 109.87 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -138.4 147.45 55.39 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 126.31 1.844 . . . . 0.0 106.214 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.79 169.12 21.93 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.729 2.286 . . . . 0.0 110.926 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -130.26 23.74 5.2 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.88 1.272 . . . . 0.0 110.202 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -152.36 169.47 22.46 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 127.007 2.123 . . . . 0.0 108.878 -171.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -91.64 154.38 19.06 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.674 0.79 . . . . 0.0 109.867 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 m -65.35 -41.21 94.08 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 169.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -139.36 139.3 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 123.85 0.86 . . . . 0.0 108.739 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -83.53 -37.83 22.53 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 169.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.61 168.28 20.17 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 118.513 0.597 . . . . 0.0 112.125 -173.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mt -133.28 137.47 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 104.94 -2.244 . . . . 0.0 104.94 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.9 mt -133.76 157.7 45.2 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.521 0.728 . . . . 0.0 109.373 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.8 mm -138.31 119.77 17.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.368 -2.827 . . . . 0.0 103.368 169.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -122.54 144.73 48.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.705 0.764 . . . . 0.0 109.158 -174.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -67.87 169.7 9.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.767 169.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -77.22 36.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.883 2.073 . . . . 0.0 111.389 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -149.62 7.26 0.65 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.278 2.231 . . . . 0.0 110.816 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.19 47.1 74.9 Favored Glycine 0 C--N 1.343 0.946 0 O-C-N 121.053 -1.029 . . . . 0.0 110.548 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -122.99 133.26 54.37 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 108.873 -177.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -64.76 119.38 10.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -173.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.1 mt -92.42 -42.38 9.79 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 159.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -148.65 154.69 40.03 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.803 0.841 . . . . 0.0 109.886 171.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.11 148.98 22.56 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.415 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -140.88 137.09 32.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 171.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -124.26 146.87 48.49 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -130.09 3.83 4.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.751 0.82 . . . . 0.0 110.992 -176.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -136.49 153.13 51.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.667 0.787 . . . . 0.0 111.054 -174.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.37 -0.49 12.54 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.285 2.234 . . . . 0.0 113.076 -173.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 p -65.6 -38.21 88.8 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.992 -1.068 . . . . 0.0 111.578 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -143.41 64.69 14.1 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.031 0.832 . . . . 0.0 110.467 -177.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -86.78 -1.02 8.11 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.851 2.367 . . . . 0.0 113.083 -175.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.6 m -133.71 137.51 45.31 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.399 1.08 . . . . 0.0 109.224 -169.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -50.64 -44.41 25.4 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 125.048 1.339 . . . . 0.0 113.47 -169.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -57.98 -45.77 86.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.667 0.667 . . . . 0.0 111.135 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.08 -35.98 64.28 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -60.26 -52.56 64.77 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.178 0.591 . . . . 0.0 109.887 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -57.78 -39.73 78.18 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.595 0.758 . . . . 0.0 110.647 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.65 83.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.098 0.559 . . . . 0.0 110.184 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -64.08 -38.66 91.87 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.44 0.696 . . . . 0.0 110.952 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -60.21 -46.56 89.33 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.631 1.972 . . . . 0.0 110.711 174.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.89 -46.29 91.2 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.026 0.83 . . . . 0.0 110.228 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -47.04 77.65 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.503 0.721 . . . . 0.0 110.752 177.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.81 -51.34 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.035 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -60.66 -46.56 89.87 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.892 0.769 . . . . 0.0 110.272 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -55.37 -43.71 75.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.455 1.102 . . . . 0.0 111.736 178.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -75.24 -49.73 18.4 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.999 0.52 . . . . 0.0 110.417 -177.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.1 p -68.57 -30.66 69.47 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.731 -0.605 . . . . 0.0 111.887 -172.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -58.22 -23.85 57.16 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.291 -0.881 . . . . 0.0 111.541 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.41 20.95 17.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.487 1.515 . . . . 0.0 110.339 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 84.4 m -125.29 156.6 38.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 108.949 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -84.62 35.1 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.526 1.53 . . . . 0.0 112.679 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.7 m 65.86 -176.91 0.19 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.249 1.82 . . . . 0.0 113.446 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.312 9.6 pt-20 56.31 -42.11 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 131.536 3.934 . . . . 0.0 117.006 -176.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.7 tt -158.02 151.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 120.245 1.384 . . . . 0.0 110.024 -173.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.81 177.74 9.27 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.434 1.893 . . . . 0.0 108.291 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 tt -140.57 125.61 18.43 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 170.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -77.29 -65.88 0.9 Allowed 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -169.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -142.72 4.04 1.49 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.195 1.798 . . . . 0.0 110.915 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.48 -40.95 0.67 Allowed Glycine 0 CA--C 1.525 0.666 0 C-N-CA 125.773 1.654 . . . . 0.0 109.319 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.84 126.91 29.96 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 170.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.1 m -80.22 146.21 31.84 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.4 p -136.71 121.15 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.42 142.4 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.865 -2.642 . . . . 0.0 103.865 168.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -152.43 167.11 29.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.555 0.693 . . . . 0.0 110.892 176.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -154.78 154.26 32.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -172.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -140.01 130.93 26.1 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -149.92 148.21 28.83 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.179 0.591 . . . . 0.0 109.633 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.4 mp 53.28 -89.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.772 2.029 . . . . 0.0 111.147 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -147.6 33.97 0.86 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.772 2.029 . . . . 0.0 108.903 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.3 tp -140.19 150.65 44.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.69 1.596 . . . . 0.0 110.47 -168.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -126.28 144.76 50.68 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -129.61 143.83 51.0 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.284 1.834 . . . . 0.0 107.764 -173.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -149.52 150.35 32.17 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.459 1.027 . . . . 0.0 111.774 -172.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.5 t -139.58 119.66 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -104.53 138.01 31.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 106.187 -1.782 . . . . 0.0 106.187 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.68 176.73 31.54 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-O 122.369 0.983 . . . . 0.0 112.666 177.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.8 m -61.49 157.05 17.95 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.619 1.568 . . . . 0.0 112.328 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 m -72.92 34.38 0.07 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.01 2.124 . . . . 0.0 112.083 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -70.28 176.98 3.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.429 1.492 . . . . 0.0 111.355 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -63.96 -12.91 41.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.07 1.748 . . . . 0.0 112.963 -177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -144.75 161.61 38.8 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.85 0.86 . . . . 0.0 110.581 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -9.23 8.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.559 2.744 . . . . 0.0 110.202 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.23 -31.93 69.51 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.903 1.281 . . . . 0.0 110.609 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -64.56 -35.59 81.48 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.396 0.998 . . . . 0.0 111.96 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.96 -43.14 72.15 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 30.8 tpp -64.88 -33.88 77.05 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.131 0.572 . . . . 0.0 111.174 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.42 -50.41 67.7 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.749 1.22 . . . . 0.0 109.949 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.9 t -60.17 -44.97 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.336 0.516 . . . . 0.0 110.097 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.93 -53.01 63.17 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.339 0.656 . . . . 0.0 110.091 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -60.39 -43.54 96.56 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.884 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.15 -45.9 92.76 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.257 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.0 tp -64.37 -49.35 71.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.999 0.818 . . . . 0.0 110.406 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -59.46 -46.62 88.27 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.47 0.176 . . . . 0.0 110.847 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -69.23 -38.44 78.51 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 118.813 -0.613 . . . . 0.0 111.03 -176.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.1 m -59.5 -50.96 71.9 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.799 0.84 . . . . 0.0 110.803 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt -54.91 -45.97 74.82 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -61.33 -37.38 83.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.791 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -68.82 -55.51 10.95 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 120.091 1.314 . . . . 0.0 109.432 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -74.16 -36.97 64.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.699 -169.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.6 tp -82.93 -28.76 29.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.887 0.767 . . . . 0.0 111.918 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 40.11 54.01 2.74 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.771 1.628 . . . . 0.0 112.831 -171.052 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -135.16 -179.51 5.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.89 2.076 . . . . 0.0 106.914 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -1.49 12.39 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 177.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.313 11.9 m 48.47 38.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.161 2.184 . . . . 0.0 111.87 -174.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -66.21 171.26 4.87 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.259 1.023 . . . . 0.0 110.023 171.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -60.54 -37.74 82.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -62.04 -45.47 93.41 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.495 1.043 . . . . 0.0 110.003 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.78 -33.1 73.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.512 0.325 . . . . 0.0 111.125 -174.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.326 0.0 OUTLIER -81.16 -32.93 33.42 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.518 -1.364 . . . . 0.0 110.95 176.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.3 tp -60.95 -36.74 80.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.293 0.951 . . . . 0.0 111.22 169.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.12 -7.96 59.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.319 -0.863 . . . . 0.0 112.845 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.82 30.79 5.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.457 1.103 . . . . 0.0 112.702 175.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -41.07 -46.08 2.84 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.167 1.387 . . . . 0.0 112.667 174.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.98 -40.55 96.65 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.056 0.843 . . . . 0.0 111.451 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.8 -42.79 98.4 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.58 -49.56 75.97 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.414 1.086 . . . . 0.0 110.543 173.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -56.09 -47.25 78.36 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 118.693 0.679 . . . . 0.0 109.734 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.5 mt -67.74 -36.98 81.53 Favored 'General case' 0 CA--C 1.527 0.072 0 CA-C-O 118.859 -0.591 . . . . 0.0 111.121 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.55 -45.37 93.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.076 0.853 . . . . 0.0 110.054 175.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.07 -49.4 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 118.673 0.67 . . . . 0.0 109.348 176.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.49 -23.29 62.64 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.415 1.086 . . . . 0.0 113.05 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -97.21 -19.59 18.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.655 1.182 . . . . 0.0 111.809 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 61.2 mt -88.79 -40.86 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.394 0.997 . . . . 0.0 109.474 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.2 m -140.32 145.27 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.97 1.308 . . . . 0.0 109.539 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -144.61 134.32 23.57 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.625 1.57 . . . . 0.0 107.302 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.44 28.67 51.48 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.369 -0.684 . . . . 0.0 113.07 -176.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.09 15.98 81.12 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 118.23 1.015 . . . . 0.0 113.678 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 59.4 t -131.6 140.07 49.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 119.326 1.563 . . . . 0.0 107.517 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.0 pt -62.46 146.12 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.975 -0.453 . . . . 0.0 110.522 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.55 -5.39 3.29 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.739 0.815 . . . . 0.0 112.392 172.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -153.57 154.55 34.47 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 169.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.2 m -140.1 24.46 2.34 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.654 1.182 . . . . 0.0 110.856 -171.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -140.15 122.61 9.96 Favored Pre-proline 0 C--O 1.234 0.251 0 C-N-CA 124.476 1.11 . . . . 0.0 108.201 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.92 -30.45 16.89 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.379 2.053 . . . . 0.0 111.819 -169.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.28 -41.24 73.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 121.473 -0.767 . . . . 0.0 109.11 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.97 -39.48 87.22 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.676 0.671 . . . . 0.0 109.905 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.96 -55.59 11.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.57 -39.19 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.37 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -60.36 -46.55 89.56 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.513 1.051 . . . . 0.0 110.743 176.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -72.68 -31.79 65.31 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.862 1.21 . . . . 0.0 111.754 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.92 -41.49 89.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 119.393 0.997 . . . . 0.0 109.432 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.38 -35.78 71.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.033 0.533 . . . . 0.0 111.85 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.32 -25.97 59.88 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.889 0.875 . . . . 0.0 112.397 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.295 171.327 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.4 mmt . . . . . 0 N--CA 1.485 1.277 0 CA-C-O 120.739 0.304 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -63.89 -32.13 73.55 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.453 0.701 . . . . 0.0 111.669 177.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.74 160.1 43.81 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.796 1.638 . . . . 0.0 108.252 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 tp -54.19 -33.16 57.5 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.168 1.387 . . . . 0.0 112.481 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 pp -129.49 40.48 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.616 1.966 . . . . 0.0 109.53 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.09 -38.79 62.87 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 169.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -134.3 147.56 64.15 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 104.967 -2.235 . . . . 0.0 104.967 168.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -80.24 45.17 1.9 Allowed 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.788 2.992 . . . . 0.0 111.409 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.2 p -77.52 46.26 0.52 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.275 1.83 . . . . 0.0 111.912 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.52 172.17 14.41 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 127.126 2.17 . . . . 0.0 109.033 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.39 154.68 49.95 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.506 0.723 . . . . 0.0 110.903 -170.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 m -60.41 -34.28 73.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.505 1.122 . . . . 0.0 110.414 176.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.45 142.38 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -96.16 -41.7 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.412 1.085 . . . . 0.0 109.593 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.15 168.33 20.95 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.401 0.546 . . . . 0.0 111.642 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.9 137.08 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 127.292 2.237 . . . . 0.0 104.986 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 mt -133.89 151.26 51.45 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 62.6 mt -136.83 120.49 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 103.691 -2.707 . . . . 0.0 103.691 169.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.6 mt -123.68 148.84 46.14 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.733 0.813 . . . . 0.0 108.818 -169.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.68 172.25 3.6 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.685 0.755 . . . . 0.0 109.439 170.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.89 7.07 0.41 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.389 1.876 . . . . 0.0 114.054 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -131.66 11.0 4.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.873 1.669 . . . . 0.0 110.839 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.46 4.37 83.36 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.271 -0.893 . . . . 0.0 113.538 176.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -69.72 130.51 42.53 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.024 1.412 . . . . 0.0 110.197 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -67.14 105.5 1.71 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.397 1.079 . . . . 0.0 110.595 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.9 mt -81.55 -43.96 17.99 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 166.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -147.08 152.91 39.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.037 0.935 . . . . 0.0 109.741 174.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.11 149.98 19.88 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.045 0.938 . . . . 0.0 108.875 168.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -143.18 139.9 30.53 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 125.564 1.546 . . . . 0.0 106.941 169.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -127.27 150.11 49.71 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -129.29 -2.84 4.99 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -171.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -138.04 173.11 11.98 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.141 0.882 . . . . 0.0 110.921 -176.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -72.09 61.99 0.45 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.799 2.439 . . . . 0.0 109.044 174.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.6 m -154.31 91.99 1.47 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.638 -3.097 . . . . 0.0 102.638 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 55.43 60.9 8.91 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.377 1.471 . . . . 0.0 111.042 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -79.98 -2.73 12.3 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.5 2.133 . . . . 0.0 113.731 -175.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -136.22 141.88 44.01 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.379 0.99 . . . . 0.0 109.853 -169.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.2 t -43.92 -52.05 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 126.529 1.932 . . . . 0.0 113.326 -169.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -58.92 -42.72 90.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.527 0.603 . . . . 0.0 111.206 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.69 -32.39 63.91 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.678 0.391 . . . . 0.0 110.175 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -63.93 -48.83 74.98 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 123.232 0.613 . . . . 0.0 109.848 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -58.48 -35.74 72.66 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 118.754 0.706 . . . . 0.0 111.39 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.74 -48.74 70.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -63.3 -37.44 87.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.866 0.466 . . . . 0.0 111.189 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.7 -45.2 83.71 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.88 1.672 . . . . 0.0 111.004 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -60.8 -44.55 96.71 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.939 -0.475 . . . . 0.0 109.902 173.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.36 -46.51 79.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.251 0.62 . . . . 0.0 111.355 174.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.5 mm -57.59 -55.7 19.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 C-N-CA 124.468 1.107 . . . . 0.0 108.312 -178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -64.92 -41.04 95.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.982 0.356 . . . . 0.0 110.539 -175.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -59.42 -41.04 88.61 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.866 -0.521 . . . . 0.0 111.804 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -81.3 -45.71 15.8 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.22 0.463 . . . . 0.0 110.346 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.6 p -70.44 -26.89 63.86 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -169.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -74.2 -3.82 32.18 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.248 1.385 . . . . 0.0 112.091 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.3 mtt-85 -113.58 16.39 18.71 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 110.075 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -131.89 157.64 43.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.108 1.363 . . . . 0.0 108.599 -169.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.01 85.55 4.23 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.477 1.111 . . . . 0.0 109.67 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.406 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 5.5 m -47.07 136.85 8.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.051 1.74 . . . . 0.0 115.509 -169.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.06 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.454 1 C-N-CA 132.906 4.482 . . . . 0.0 107.433 173.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.29 156.82 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.561 1.544 . . . . 0.0 108.485 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.36 171.02 18.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.752 2.021 . . . . 0.0 108.721 174.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.8 tp -133.45 114.31 13.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 mp -114.24 98.82 7.17 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -174.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 57.72 14.33 2.39 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.224 1.81 . . . . 0.0 114.193 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.43 -31.2 2.9 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.683 1.611 . . . . 0.0 111.768 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.7 mt -83.28 129.94 35.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.433 1.116 . . . . 0.0 109.208 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -74.76 141.66 44.39 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 171.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 97.5 t -137.54 131.51 44.06 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.093 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.5 m -118.38 144.75 25.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 169.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.406 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 31.2 p90 -162.18 164.3 27.9 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 111.803 -170.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -150.04 175.01 12.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.024 0.93 . . . . 0.0 108.594 169.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.3 p -139.61 145.35 38.43 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -145.69 137.9 25.52 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 11.8 mt 64.77 -82.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.21 1.804 . . . . 0.0 110.896 170.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -152.9 28.8 0.52 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.392 1.877 . . . . 0.0 108.934 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.6 tp -139.4 146.3 39.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 125.984 1.714 . . . . 0.0 109.428 -168.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -126.07 145.97 50.11 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.142 1.377 . . . . 0.0 107.482 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -136.21 138.07 41.5 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 -170.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -145.85 149.3 34.03 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.875 0.87 . . . . 0.0 111.359 -170.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.8 t -138.15 138.62 43.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 169.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.08 139.25 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -172.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -156.81 177.7 33.6 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-O 122.118 0.843 . . . . 0.0 112.594 -173.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.4 m -59.54 162.24 5.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.678 1.591 . . . . 0.0 112.452 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -71.84 27.46 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.698 1.999 . . . . 0.0 112.207 171.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -71.78 173.46 8.17 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.384 1.073 . . . . 0.0 112.142 -169.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.38 -7.59 38.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.74 1.616 . . . . 0.0 113.328 -172.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -141.8 159.87 41.33 Favored 'General case' 0 C--N 1.339 0.126 0 CA-C-N 119.061 0.846 . . . . 0.0 110.36 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.49 -6.57 10.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.322 2.249 . . . . 0.0 110.317 173.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -36.36 71.81 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.961 1.304 . . . . 0.0 111.099 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -65.86 -33.95 77.02 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.871 0.76 . . . . 0.0 111.675 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 34.3 mt -73.53 -42.48 61.69 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.0 mmt -56.64 -40.17 74.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.011 0.524 . . . . 0.0 110.06 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.89 -49.33 73.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.546 0.738 . . . . 0.0 109.887 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.0 t -60.14 -45.53 95.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 118.118 0.417 . . . . 0.0 110.166 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.5 tp -60.02 -49.29 78.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 122.903 0.481 . . . . 0.0 110.366 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.26 -42.02 96.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.846 -0.597 . . . . 0.0 110.594 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.2 m -60.11 -48.51 81.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.896 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 44.8 tp -64.86 -46.47 81.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.566 1.075 . . . . 0.0 111.155 -176.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.29 -46.88 88.31 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 122.999 0.52 . . . . 0.0 110.916 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.26 -26.4 52.45 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.33 -0.856 . . . . 0.0 111.641 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.7 m -62.98 -50.29 71.37 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.134 0.879 . . . . 0.0 110.313 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.2 mt -52.0 -47.75 64.79 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -58.92 -25.57 63.57 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.706 -1.14 . . . . 0.0 113.909 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -85.58 -53.5 5.13 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 121.041 1.746 . . . . 0.0 110.951 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -75.18 -38.11 60.98 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.598 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 tp -82.0 -39.1 24.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.959 0.504 . . . . 0.0 110.062 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.272 26.0 ptt-85 39.05 53.02 2.08 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.162 1.785 . . . . 0.0 112.237 -178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -131.96 -169.82 2.28 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 128.215 2.606 . . . . 0.0 105.703 169.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -72.48 7.3 1.9 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.296 16.8 m 44.76 41.05 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.914 2.086 . . . . 0.0 112.164 -171.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -73.5 160.31 31.89 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.262 1.025 . . . . 0.0 109.485 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 33.4 pttt -60.37 -32.49 71.35 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -172.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -37.44 75.05 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.761 0.424 . . . . 0.0 110.258 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.74 -34.83 72.29 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.319 173.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -60.42 -45.38 93.82 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.962 -1.086 . . . . 0.0 110.441 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.79 -39.34 73.92 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.66 0.784 . . . . 0.0 111.094 175.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -63.66 -25.61 68.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.09 27.38 5.4 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 118.787 0.721 . . . . 0.0 112.689 -171.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -40.7 -48.82 3.02 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 125.074 1.349 . . . . 0.0 112.247 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.41 -40.29 96.8 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.819 0.736 . . . . 0.0 111.722 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.17 -44.33 97.87 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.79 -50.0 75.57 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.464 1.105 . . . . 0.0 110.322 175.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -54.91 -48.78 72.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.667 0.667 . . . . 0.0 109.897 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.91 -37.52 84.51 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.181 0.592 . . . . 0.0 111.194 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.81 90.38 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.655 0.661 . . . . 0.0 109.867 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.3 t -57.31 -44.38 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.564 0.62 . . . . 0.0 109.529 175.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -71.66 1.48 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.133 0.973 . . . . 0.0 113.433 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -118.28 -12.03 9.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.666 1.586 . . . . 0.0 111.34 172.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.6 mt -88.06 -40.57 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 24.0 t -133.69 145.61 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.319 1.048 . . . . 0.0 110.513 -169.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -144.87 130.7 19.16 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 125.846 1.658 . . . . 0.0 106.898 168.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.78 29.61 55.0 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 119.398 -0.668 . . . . 0.0 113.868 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.65 16.22 80.43 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.288 1.044 . . . . 0.0 113.289 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.5 t -127.91 138.45 54.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.9 pt -66.2 147.06 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.6 pp -128.03 -11.69 5.3 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.246 1.018 . . . . 0.0 111.692 177.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -147.79 157.22 43.43 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 169.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 7.3 m -141.83 26.64 1.88 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.996 0.918 . . . . 0.0 110.862 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -141.97 128.76 11.24 Favored Pre-proline 0 C--O 1.236 0.346 0 C-N-CA 124.084 0.953 . . . . 0.0 108.501 177.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.48 -38.55 8.24 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.846 2.364 . . . . 0.0 113.67 -172.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.281 0.0 OUTLIER -76.36 -26.98 56.25 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.873 -1.142 . . . . 0.0 110.162 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 -66.18 -44.33 84.32 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.537 1.062 . . . . 0.0 109.618 169.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.4 t -54.88 -51.64 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 118.926 0.785 . . . . 0.0 109.541 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.39 -38.22 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.05 0.841 . . . . 0.0 110.693 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -62.92 -38.85 92.62 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.674 1.125 . . . . 0.0 110.947 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 25.2 mtt-85 -64.01 -46.73 83.21 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.925 0.784 . . . . 0.0 109.998 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.7 t -58.34 -41.41 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.95 -33.95 74.54 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.553 0.741 . . . . 0.0 111.994 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 29.9 mt -72.34 -32.15 66.25 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.042 0.937 . . . . 0.0 111.983 177.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.332 -0.842 . . . . 0.0 109.998 176.647 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.1 -26.91 62.33 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.145 0.884 . . . . 0.0 112.231 -172.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 30.36 -90.6 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 129.19 2.996 . . . . 0.0 114.736 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.89 -33.83 62.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.589 1.155 . . . . 0.0 112.169 -176.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.6 mm -123.21 36.49 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 125.534 1.534 . . . . 0.0 108.08 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.98 -31.2 68.55 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.124 -0.985 . . . . 0.0 110.116 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -136.67 155.07 76.93 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 127.05 2.14 . . . . 0.0 106.0 169.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -64.99 145.86 86.32 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.903 1.736 . . . . 0.0 109.763 174.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -61.5 -29.3 69.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.011 0.924 . . . . 0.0 112.966 -171.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.22 178.6 9.57 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.39 1.876 . . . . 0.0 108.595 174.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -50.77 132.01 26.19 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.202 1.001 . . . . 0.0 112.679 -170.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 m -63.15 -38.59 91.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.312 1.845 . . . . 0.0 110.637 175.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.7 m -141.66 153.39 19.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 124.644 1.178 . . . . 0.0 108.036 175.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -111.75 -28.7 7.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 117.206 -1.378 . . . . 0.0 110.688 174.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.14 166.66 25.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.14 1.336 . . . . 0.0 112.38 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.4 mt -136.21 136.67 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mt -135.41 154.02 51.6 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.048 0.939 . . . . 0.0 108.682 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.9 mt -138.83 123.87 21.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 169.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.5 mt -129.15 149.07 51.11 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -171.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.432 ' C ' ' H ' ' A' ' 22' ' ' ASP . 15.8 t0 -65.61 172.68 3.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.548 170.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -74.4 30.05 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.906 2.083 . . . . 0.0 111.878 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 20' ' ' ASP . 36.8 t70 -147.98 7.66 0.83 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.278 2.231 . . . . 0.0 110.79 176.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.54 10.06 86.51 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 121.001 -1.062 . . . . 0.0 113.105 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -72.35 129.68 38.97 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 118.751 1.276 . . . . 0.0 109.949 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.74 106.84 0.73 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 125.315 1.446 . . . . 0.0 109.996 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.6 -44.41 8.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 166.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -147.29 151.5 36.72 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.754 0.822 . . . . 0.0 109.531 172.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.89 145.12 15.27 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 169.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -146.98 146.85 30.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.939 1.295 . . . . 0.0 108.181 174.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -135.23 149.64 49.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.259 1.424 . . . . 0.0 107.704 -174.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -132.62 0.34 3.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.674 1.19 . . . . 0.0 111.612 -174.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -131.9 160.63 35.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.845 0.858 . . . . 0.0 108.796 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.26 6.12 3.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.595 1.958 . . . . 0.0 112.897 -170.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 p -61.99 -48.63 79.47 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.823 1.249 . . . . 0.0 110.735 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -144.84 73.48 14.97 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.233 1.013 . . . . 0.0 109.212 -175.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -85.01 -2.51 9.59 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.459 2.106 . . . . 0.0 113.956 -173.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -137.65 140.73 41.01 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.368 0.985 . . . . 0.0 110.054 -169.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.23 -43.95 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.14 1.376 . . . . 0.0 113.229 -169.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -59.26 -38.29 79.71 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 117.799 0.272 . . . . 0.0 111.428 -176.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -85.84 -32.51 21.69 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.012 0.369 . . . . 0.0 110.236 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.6 -51.88 66.71 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 123.269 0.628 . . . . 0.0 110.201 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -60.41 -31.67 70.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.546 -0.721 . . . . 0.0 111.348 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.81 -48.13 67.13 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -61.51 -36.55 80.84 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.031 0.532 . . . . 0.0 111.055 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -66.83 -44.08 82.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.602 1.561 . . . . 0.0 111.311 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -60.71 -44.11 97.0 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.677 -0.639 . . . . 0.0 110.014 172.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.66 -45.95 81.37 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.599 0.76 . . . . 0.0 111.224 174.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.62 -53.35 45.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 C-N-CA 124.259 1.024 . . . . 0.0 108.474 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -62.5 -46.05 90.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.477 0.58 . . . . 0.0 110.362 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 -56.09 -42.45 76.76 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.997 0.919 . . . . 0.0 111.915 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -78.69 -47.83 16.17 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.171 0.589 . . . . 0.0 110.156 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.0 p -66.88 -30.38 70.52 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.54 -0.725 . . . . 0.0 111.851 -175.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -59.71 -20.72 58.24 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.363 -0.835 . . . . 0.0 112.23 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -108.58 17.63 21.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.842 1.657 . . . . 0.0 110.433 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 56.4 m -121.61 163.33 19.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.89 1.276 . . . . 0.0 108.942 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -95.63 25.5 4.52 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.076 1.75 . . . . 0.0 113.333 -169.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.429 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.0 m 73.82 176.88 0.24 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.315 1.846 . . . . 0.0 113.227 172.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.319 10.5 pt-20 56.33 -43.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 131.072 3.749 . . . . 0.0 116.354 -173.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -148.11 155.85 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 120.303 1.411 . . . . 0.0 109.766 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.85 167.03 27.74 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.248 2.219 . . . . 0.0 108.133 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 tp -135.08 116.07 14.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mp -117.35 97.29 5.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -172.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 57.45 15.92 2.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.225 1.81 . . . . 0.0 114.082 171.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.99 -28.36 3.91 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.7 1.619 . . . . 0.0 111.971 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.3 mt -82.26 128.27 34.02 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.474 1.137 . . . . 0.0 109.178 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.8 m -75.88 138.24 40.94 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 172.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.9 t -136.9 133.48 48.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.8 m -118.87 146.85 22.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 169.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.429 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -158.16 162.77 37.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.166 0.508 . . . . 0.0 110.981 -175.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -148.16 174.76 11.64 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.236 1.014 . . . . 0.0 108.418 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -139.76 146.58 39.69 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 169.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.1 m -142.45 137.66 30.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.89 0.876 . . . . 0.0 108.691 177.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.8 mt 63.17 -76.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 127.26 2.224 . . . . 0.0 110.805 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -156.37 31.35 0.33 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.719 1.608 . . . . 0.0 109.999 176.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.1 tp -140.17 149.46 43.0 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.293 1.437 . . . . 0.0 109.421 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -124.19 149.97 45.75 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.537 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -139.77 142.91 36.72 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.369 1.468 . . . . 0.0 107.862 -172.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -147.44 152.43 38.08 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.666 0.786 . . . . 0.0 111.189 -170.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.7 t -138.9 140.14 39.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 169.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.47 140.56 48.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.54 -179.86 34.64 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-O 122.664 1.147 . . . . 0.0 112.074 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.4 m -64.69 164.74 11.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.735 1.614 . . . . 0.0 112.557 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.2 p -74.02 37.93 0.1 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.997 2.119 . . . . 0.0 111.377 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -68.03 169.4 10.15 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.577 1.151 . . . . 0.0 110.819 -175.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.48 -4.18 21.51 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.651 1.18 . . . . 0.0 113.558 -174.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -149.35 172.63 14.6 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.368 1.467 . . . . 0.0 108.786 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.38 -1.98 3.51 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.055 2.542 . . . . 0.0 110.256 -176.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -64.49 -30.9 71.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.737 1.215 . . . . 0.0 110.51 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -35.06 79.28 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.263 0.938 . . . . 0.0 111.497 172.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -69.37 -46.41 67.02 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.1 mmt -55.25 -41.35 72.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.39 174.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.13 -50.08 71.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.005 0.922 . . . . 0.0 110.038 -179.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.33 -43.77 97.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.217 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.2 tp -60.89 -48.9 79.69 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 118.482 0.583 . . . . 0.0 110.486 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -63.67 -44.11 94.73 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.351 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 92.5 m -60.35 -47.06 87.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.147 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.6 tp -64.86 -49.12 71.78 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 119.057 0.844 . . . . 0.0 110.787 -177.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.59 -42.36 98.75 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.175 0.443 . . . . 0.0 110.927 -177.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -73.14 -36.63 66.71 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.49 -0.756 . . . . 0.0 111.173 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 20.8 m -63.76 -43.34 96.71 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.971 0.805 . . . . 0.0 110.85 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.8 mt -53.7 -50.35 66.07 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.9 m -57.18 -38.69 73.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.368 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.6 -49.54 66.0 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.35 -0.833 . . . . 0.0 111.54 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 4.2 ptp -69.99 -34.98 74.03 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.379 0.99 . . . . 0.0 111.211 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.43 -43.14 64.26 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.868 0.467 . . . . 0.0 111.024 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 51.96 27.21 4.2 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.065 1.346 . . . . 0.0 112.437 -169.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -156.59 -175.62 5.53 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.177 2.191 . . . . 0.0 107.676 177.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -46.85 123.45 5.18 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.992 1.317 . . . . 0.0 110.233 174.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 17.2 m -84.91 51.05 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.993 1.317 . . . . 0.0 108.974 171.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.11 178.21 7.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.364 1.066 . . . . 0.0 111.652 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -47.73 -54.28 12.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.65 1.18 . . . . 0.0 112.718 -175.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -65.04 -41.37 95.28 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.313 0.506 . . . . 0.0 109.733 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.83 76.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.151 0.581 . . . . 0.0 111.97 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -69.54 -49.56 53.21 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 123.984 0.914 . . . . 0.0 110.253 171.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.6 tp -56.33 -37.41 69.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.808 0.843 . . . . 0.0 111.263 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -81.98 -3.31 54.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.543 0.737 . . . . 0.0 112.339 -178.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -132.91 22.43 4.19 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.786 1.235 . . . . 0.0 112.209 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -43.4 21.36 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.207 1.003 . . . . 0.0 111.724 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.26 -42.88 92.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.853 0.752 . . . . 0.0 111.466 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.14 -41.49 99.7 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 177.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.16 -48.92 78.79 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.559 1.144 . . . . 0.0 110.672 173.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.09 -45.52 83.29 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 118.808 0.731 . . . . 0.0 109.683 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.68 -35.38 78.73 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.164 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.25 89.7 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 119.081 0.855 . . . . 0.0 110.145 175.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.1 t -57.52 -47.74 84.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.11 -21.73 63.99 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.487 1.115 . . . . 0.0 113.158 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -97.64 -22.8 16.28 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.277 1.031 . . . . 0.0 111.562 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 67.4 mt -83.13 -45.29 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.3 0.954 . . . . 0.0 108.976 177.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 m -139.89 153.26 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.413 1.085 . . . . 0.0 110.684 -171.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -149.32 140.69 23.24 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.347 1.459 . . . . 0.0 107.85 169.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.45 28.01 54.84 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.464 -0.631 . . . . 0.0 113.463 177.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.68 17.79 79.57 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.194 0.997 . . . . 0.0 113.41 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 56.4 t -132.41 142.08 43.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 119.07 1.435 . . . . 0.0 107.383 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.6 pt -65.18 151.21 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 O-C-N 121.976 -0.452 . . . . 0.0 110.284 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 pp -134.32 -10.58 2.52 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.867 0.867 . . . . 0.0 111.939 170.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -149.01 155.61 41.04 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.3 m -140.31 23.56 2.35 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.241 1.417 . . . . 0.0 110.878 -170.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -140.46 125.1 10.91 Favored Pre-proline 0 C--O 1.236 0.356 0 C-N-CA 124.208 1.003 . . . . 0.0 108.865 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.88 -34.31 5.4 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.322 2.015 . . . . 0.0 113.924 -169.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.308 2.3 pp0? -76.11 -27.3 57.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.945 -1.097 . . . . 0.0 110.304 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -67.54 -45.29 76.1 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.357 0.98 . . . . 0.0 109.501 169.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.5 t -54.21 -56.52 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.58 -33.47 63.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.237 0.926 . . . . 0.0 110.656 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -50.31 74.24 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.334 0.97 . . . . 0.0 109.824 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -69.07 -30.92 69.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.996 1.271 . . . . 0.0 112.462 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.65 -43.92 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.661 1.119 . . . . 0.0 109.742 171.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.66 -31.08 66.43 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.095 0.558 . . . . 0.0 111.884 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.6 tp -68.76 -33.96 74.78 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 125.696 1.598 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 63.5 mtt85 . . . . . 0 C--O 1.249 1.052 0 O-C-N 123.383 0.427 . . . . 0.0 110.405 173.547 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 tpt . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -63.92 -42.72 97.31 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.066 0.547 . . . . 0.0 111.406 -172.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.06 150.02 26.79 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.733 1.613 . . . . 0.0 106.949 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -65.58 -8.91 22.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.6 mt -130.0 38.26 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.766 1.226 . . . . 0.0 108.859 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.9 tp -57.34 -31.65 65.93 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.53 169.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -127.69 151.37 75.23 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.951 2.1 . . . . 0.0 105.407 169.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -62.4 132.17 37.2 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.788 2.326 . . . . 0.0 110.692 -171.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.6 p -70.13 -24.17 63.13 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.854 1.262 . . . . 0.0 112.402 -174.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -152.55 -179.83 7.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.513 1.925 . . . . 0.0 108.785 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -45.45 126.15 6.32 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.672 1.589 . . . . 0.0 111.69 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 p -69.01 -37.52 78.73 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.4 m -139.82 157.56 26.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 174.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -121.94 -28.83 4.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.589 1.155 . . . . 0.0 111.058 -172.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -158.04 163.94 37.21 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.704 1.138 . . . . 0.0 110.689 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.8 mt -135.06 135.16 52.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.2 mt -133.91 149.31 51.29 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.92 116.72 14.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 103.592 -2.744 . . . . 0.0 103.592 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.8 mt -124.44 145.38 49.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.08 169.03 7.45 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.304 0.574 . . . . 0.0 110.305 169.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -13.77 1.93 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -178.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -112.99 5.9 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.649 1.18 . . . . 0.0 110.844 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.99 7.27 59.85 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 125.021 1.296 . . . . 0.0 112.666 173.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.44 131.69 45.16 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 119.252 1.526 . . . . 0.0 109.738 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -58.21 127.49 32.37 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.9 mt -107.84 -40.16 5.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 161.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -148.08 153.11 38.46 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 123.382 0.673 . . . . 0.0 109.713 170.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.5 145.9 19.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.208 1.003 . . . . 0.0 108.449 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.98 139.15 27.3 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.873 1.669 . . . . 0.0 106.77 176.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -128.63 151.02 49.96 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.928 1.291 . . . . 0.0 108.18 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -134.04 22.3 3.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.698 1.999 . . . . 0.0 108.4 174.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.72 147.98 48.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.652 1.581 . . . . 0.0 111.39 -168.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -96.73 -6.87 35.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.521 1.528 . . . . 0.0 111.953 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.5 m -70.68 -38.22 73.72 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.31 -0.869 . . . . 0.0 109.649 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -136.41 67.59 60.32 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 125.029 1.332 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -87.77 -1.33 7.34 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.768 2.312 . . . . 0.0 113.645 -176.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.8 m -135.23 141.0 45.71 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.065 0.848 . . . . 0.0 110.22 -169.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -46.03 -50.03 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.422 1.889 . . . . 0.0 112.736 -169.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -55.83 -47.29 77.46 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.144 0.429 . . . . 0.0 111.304 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -79.27 -32.42 43.67 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -177.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.34 -50.83 72.04 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 123.439 0.696 . . . . 0.0 110.624 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -62.7 -31.84 72.82 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.972 0.806 . . . . 0.0 111.132 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.95 72.15 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.914 -0.491 . . . . 0.0 110.007 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.91 -42.96 99.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.24 0.616 . . . . 0.0 110.223 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.14 -42.7 91.28 Favored 'General case' 0 C--N 1.334 -0.092 0 C-N-CA 126.562 1.945 . . . . 0.0 112.063 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -59.72 -43.32 94.22 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 118.996 0.816 . . . . 0.0 109.594 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -45.01 91.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 118.055 -0.974 . . . . 0.0 111.627 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.25 -55.55 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -58.61 -45.51 89.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.897 0.879 . . . . 0.0 110.702 -174.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -54.57 -45.52 73.54 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.267 1.027 . . . . 0.0 111.453 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -70.83 -49.58 44.82 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 119.065 -0.493 . . . . 0.0 110.348 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 37.2 p -67.62 -31.3 71.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.54 1.064 . . . . 0.0 111.398 -173.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -59.27 -23.89 62.77 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.606 0.762 . . . . 0.0 111.304 172.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -120.71 36.06 4.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.315 1.446 . . . . 0.0 109.797 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.9 m -127.98 158.17 38.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.822 1.649 . . . . 0.0 106.581 170.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.75 -59.61 3.41 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.741 -0.6 . . . . 0.0 111.037 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m 177.57 -169.47 0.08 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.73 3.212 . . . . 0.0 107.286 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.322 10.4 pt-20 60.8 -47.91 0.11 Allowed 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 131.203 3.801 . . . . 0.0 117.196 169.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -158.41 152.72 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 121.024 1.738 . . . . 0.0 110.915 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.63 173.89 11.13 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.57 1.948 . . . . 0.0 108.775 170.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.3 tp -137.09 115.05 11.46 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.077 -2.194 . . . . 0.0 105.077 -176.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -75.62 -72.82 0.29 Allowed 'General case' 0 N--CA 1.457 -0.094 0 O-C-N 123.264 0.353 . . . . 0.0 110.138 -172.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -144.97 6.39 1.17 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.343 1.857 . . . . 0.0 110.881 -175.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 149.02 -40.27 0.9 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 126.086 1.803 . . . . 0.0 108.98 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.2 mt -68.61 142.93 55.0 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.9 m -107.86 146.44 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.9 p -139.67 118.77 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.3 m -86.41 150.05 3.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 106.282 -1.748 . . . . 0.0 106.282 169.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -153.73 166.09 33.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.582 0.706 . . . . 0.0 111.39 175.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.501 ' HE3' ' CE1' ' A' ' 98' ' ' PHE . 37.6 tttp -152.17 156.93 40.77 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.896 1.679 . . . . 0.0 106.758 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -136.13 135.53 39.33 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m -142.07 142.74 32.86 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.626 0.77 . . . . 0.0 109.382 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 mp 53.71 -85.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.156 2.182 . . . . 0.0 111.898 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -150.14 31.93 0.68 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.41 1.884 . . . . 0.0 108.806 -176.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.7 tp -140.38 145.21 36.81 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.494 1.918 . . . . 0.0 108.571 -169.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -127.79 140.25 52.16 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.679 1.192 . . . . 0.0 107.803 -179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -123.68 141.48 51.98 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.675 1.59 . . . . 0.0 107.47 -176.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -146.9 152.31 38.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 119.013 0.824 . . . . 0.0 110.524 -175.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 63.5 t -141.06 122.61 14.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 105.801 -1.925 . . . . 0.0 105.801 169.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -99.19 142.11 15.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.64 174.82 38.21 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-O 121.892 0.718 . . . . 0.0 112.4 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.31 176.5 3.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.148 1.379 . . . . 0.0 109.74 173.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.0 p -152.34 72.9 1.01 Allowed 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.377 -0.827 . . . . 0.0 109.383 172.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -54.94 -43.98 73.88 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.553 0.741 . . . . 0.0 111.037 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -145.17 -12.58 0.54 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.781 1.232 . . . . 0.0 112.173 172.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -156.52 175.69 13.7 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.565 1.146 . . . . 0.0 109.89 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.56 4.36 4.64 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.872 2.469 . . . . 0.0 110.585 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.2 -32.35 73.73 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 120.869 -1.144 . . . . 0.0 110.663 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -32.46 72.31 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.999 0.818 . . . . 0.0 111.682 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.89 -50.05 68.07 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 172.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.3 mmt -55.64 -41.24 73.28 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.538 0.335 . . . . 0.0 110.295 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.14 75.72 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.587 0.755 . . . . 0.0 110.287 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.91 -44.78 98.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 119.027 0.83 . . . . 0.0 110.07 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.82 -50.76 72.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.344 0.52 . . . . 0.0 110.616 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -64.24 -40.29 95.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 119.581 -0.247 . . . . 0.0 110.484 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.07 -45.56 93.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.474 0.71 . . . . 0.0 109.574 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 tp -65.08 -49.63 69.3 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.786 0.721 . . . . 0.0 111.114 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.501 ' CE1' ' HE3' ' A' ' 70' ' ' LYS . 68.5 t80 -60.93 -43.81 98.11 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.376 0.608 . . . . 0.0 110.88 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.59 -28.81 37.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.322 -0.861 . . . . 0.0 111.969 -174.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 23.3 p -66.72 -45.88 77.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 119.905 1.23 . . . . 0.0 110.01 172.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.1 mt -51.13 -49.43 60.81 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 m -58.85 -32.32 69.33 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.159 -0.924 . . . . 0.0 113.262 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -76.36 -50.64 13.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 120.603 1.547 . . . . 0.0 110.659 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -79.78 -32.21 40.88 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 119.357 -0.937 . . . . 0.0 112.95 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.3 tp -82.37 -32.54 29.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 118.058 0.39 . . . . 0.0 111.9 -170.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 46.36 47.79 13.69 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.083 1.353 . . . . 0.0 112.275 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -138.08 174.97 10.0 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.928 2.091 . . . . 0.0 105.903 169.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -72.25 15.32 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -178.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.28 24.0 m 44.06 41.7 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 127.148 2.179 . . . . 0.0 111.734 -173.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.6 170.57 15.51 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.205 1.002 . . . . 0.0 110.841 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -53.96 -42.09 68.52 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.476 0.71 . . . . 0.0 112.798 -176.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.7 tpp85 -66.57 -42.17 87.44 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-O 118.887 -0.578 . . . . 0.0 110.073 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.38 -39.03 93.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.899 0.772 . . . . 0.0 110.388 -179.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.03 -50.97 71.6 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.614 0.766 . . . . 0.0 110.089 171.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.9 tp -58.0 -37.88 75.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.51 0.724 . . . . 0.0 111.684 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -67.61 -21.88 65.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.838 0.855 . . . . 0.0 112.864 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.43 24.6 4.8 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.259 0.936 . . . . 0.0 113.12 -171.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -45.33 3.44 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.197 1.399 . . . . 0.0 112.351 177.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -66.24 -38.2 87.33 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.427 1.012 . . . . 0.0 112.275 -178.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.84 -40.55 93.68 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 175.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.27 -48.91 77.67 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.139 0.976 . . . . 0.0 110.242 170.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -57.74 -46.56 84.29 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.9 mt -65.62 -38.88 90.68 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.472 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.97 -48.73 79.07 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-N 119.039 0.836 . . . . 0.0 109.631 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.0 t -56.72 -46.78 83.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.6 . . . . 0.0 109.458 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -68.71 -0.53 5.42 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.273 1.429 . . . . 0.0 113.56 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -120.64 -15.65 8.41 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.534 1.533 . . . . 0.0 111.34 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 65.7 mt -82.36 -37.04 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.306 1.043 . . . . 0.0 109.009 169.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.07 153.51 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.27 0.941 . . . . 0.0 110.384 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -150.54 136.94 18.76 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.307 1.443 . . . . 0.0 107.248 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.75 29.74 50.41 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.488 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.46 18.34 79.34 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-N 118.067 0.933 . . . . 0.0 113.7 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 41.4 t -126.47 133.03 69.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 174.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.5 pt -60.2 156.87 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.74 0.781 . . . . 0.0 111.422 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.0 mt -120.23 -22.24 6.66 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.291 1.836 . . . . 0.0 110.271 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -154.85 160.61 41.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.036 0.835 . . . . 0.0 109.973 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 m -135.52 14.04 3.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.998 1.319 . . . . 0.0 112.205 -169.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.79 123.29 10.61 Favored Pre-proline 0 N--CA 1.465 0.277 0 C-N-CA 123.72 0.808 . . . . 0.0 110.09 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.7 -44.63 13.12 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.728 2.286 . . . . 0.0 112.941 -170.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pp0? -73.92 -26.94 60.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 119.292 -0.963 . . . . 0.0 111.07 -175.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.05 -35.2 74.08 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.547 1.521 . . . . 0.0 110.539 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.7 -43.27 87.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 119.575 1.079 . . . . 0.0 109.24 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.43 -39.47 84.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.844 1.202 . . . . 0.0 111.028 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -61.04 -45.5 94.51 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.904 1.229 . . . . 0.0 110.155 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -59.04 -47.79 83.96 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.855 -0.528 . . . . 0.0 110.017 177.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 62.6 t -59.5 -41.93 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.496 0.718 . . . . 0.0 109.912 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.05 -34.86 77.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.186 0.595 . . . . 0.0 111.782 -178.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.33 -32.32 58.63 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.944 0.898 . . . . 0.0 111.929 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.838 178.834 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.483 1.206 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -139.51 171.09 14.76 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.233 1.413 . . . . 0.0 108.031 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.15 164.08 37.34 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.196 1.398 . . . . 0.0 108.977 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.8 tp -59.15 -33.21 70.63 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.882 0.873 . . . . 0.0 111.722 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 12.4 mt -131.55 56.43 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.78 132.84 55.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.507 0.723 . . . . 0.0 109.168 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 20.83 69.12 0.27 Allowed Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 129.066 2.946 . . . . 0.0 114.565 174.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.66 162.13 42.09 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.417 2.745 . . . . 0.0 111.167 -177.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.2 m -74.78 20.38 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.05 1.34 . . . . 0.0 112.232 171.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.43 133.74 47.15 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.845 1.258 . . . . 0.0 108.909 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -125.63 131.42 52.66 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 m -54.06 -40.34 67.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.532 1.133 . . . . 0.0 111.267 -176.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.3 m -140.5 164.29 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.413 1.085 . . . . 0.0 108.692 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -122.8 -28.98 4.06 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 125.001 1.32 . . . . 0.0 110.191 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.75 166.9 27.9 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.753 1.16 . . . . 0.0 111.867 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -136.61 136.31 48.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -132.44 149.29 52.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 61.8 mt -139.1 120.39 15.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 104.175 -2.528 . . . . 0.0 104.175 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.8 mt -127.76 149.24 50.33 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.38 171.19 4.09 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -17.06 62.42 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.795 0.838 . . . . 0.0 112.354 173.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.5 -9.48 59.4 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.298 1.039 . . . . 0.0 112.095 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.44 86.01 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 0.0 112.274 -171.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -74.56 143.22 44.57 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.461 1.131 . . . . 0.0 109.941 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -59.61 133.02 55.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.626 0.648 . . . . 0.0 110.21 177.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt -106.31 -38.6 6.18 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 151.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.63 154.33 36.2 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.792 0.837 . . . . 0.0 110.632 172.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 146.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.433 1.093 . . . . 0.0 108.585 169.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.99 144.26 30.94 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 125.699 1.6 . . . . 0.0 107.505 171.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -128.81 150.47 50.3 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.554 1.542 . . . . 0.0 107.513 176.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -135.14 -0.86 2.7 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.816 0.846 . . . . 0.0 111.984 -174.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -135.02 160.2 39.07 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.885 0.766 . . . . 0.0 110.125 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -72.06 3.39 4.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.71 2.004 . . . . 0.0 113.194 -170.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -62.45 -49.04 77.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.414 1.085 . . . . 0.0 110.752 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -142.86 69.3 19.09 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.222 1.009 . . . . 0.0 109.537 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -85.74 -2.37 9.0 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.698 2.265 . . . . 0.0 113.627 -173.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.1 m -135.9 141.92 44.63 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 119.278 0.945 . . . . 0.0 109.617 -169.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.4 t -44.52 -52.82 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 126.469 1.908 . . . . 0.0 113.137 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -60.32 -45.0 94.96 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.624 0.647 . . . . 0.0 111.014 -175.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -69.98 -34.12 72.95 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -62.66 -51.5 67.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 118.625 -0.702 . . . . 0.0 109.857 174.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.97 -38.03 75.28 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.275 0.943 . . . . 0.0 111.496 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.17 -50.09 73.23 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.213 0.605 . . . . 0.0 109.609 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.52 -38.65 91.95 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.454 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.0 -45.09 96.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 126.444 1.898 . . . . 0.0 111.473 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.23 -40.03 93.52 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 121.546 -0.721 . . . . 0.0 110.035 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.03 -49.55 75.47 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.669 -0.681 . . . . 0.0 111.062 171.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -54.85 -50.71 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 124.703 1.201 . . . . 0.0 108.71 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -61.17 -49.32 77.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.67 0.388 . . . . 0.0 110.318 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -57.4 -49.37 76.41 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.893 0.477 . . . . 0.0 111.1 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm -60.46 -52.44 65.21 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.0 p -71.87 -32.16 67.19 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.903 -0.498 . . . . 0.0 111.885 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -63.12 -15.12 55.69 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.515 -0.74 . . . . 0.0 111.443 171.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -120.85 25.52 9.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.185 1.794 . . . . 0.0 109.837 -176.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 94.8 m -131.42 158.1 41.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.169 1.788 . . . . 0.0 107.711 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.18 -42.11 99.32 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 118.442 -0.79 . . . . 0.0 112.879 -170.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m 139.8 -177.71 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.805 1 C-N-CA 132.427 4.291 . . . . 0.0 108.878 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.324 10.2 pt-20 59.07 -44.03 0.07 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 131.226 3.81 . . . . 0.0 117.307 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.0 tt -150.23 155.48 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 120.61 1.55 . . . . 0.0 109.932 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.79 166.06 30.58 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.034 2.134 . . . . 0.0 108.541 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.66 115.71 14.96 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 104.331 -2.47 . . . . 0.0 104.331 171.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 pp -147.28 138.42 23.8 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.896 0.878 . . . . 0.0 109.565 -172.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 52.42 27.04 4.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.002 1.321 . . . . 0.0 112.196 -177.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.82 4.3 90.39 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.585 1.088 . . . . 0.0 113.525 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -108.74 138.85 44.39 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.453 1.501 . . . . 0.0 108.751 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 51.2 m -83.15 136.99 34.24 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 72.3 t -135.07 138.41 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 32.0 m -120.48 147.43 24.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -158.73 162.37 37.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.93 0.395 . . . . 0.0 110.958 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -149.71 175.83 11.23 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.457 1.103 . . . . 0.0 108.514 170.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.4 p -142.37 146.65 35.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 169.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -145.44 149.03 33.97 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.318 1.047 . . . . 0.0 109.115 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 mp 50.36 -90.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.151 1.781 . . . . 0.0 110.989 -172.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -148.55 36.71 0.81 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.411 1.884 . . . . 0.0 108.99 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 64.3 tp -134.14 145.21 49.06 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 127.24 2.216 . . . . 0.0 107.889 -169.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -125.02 144.98 50.12 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -133.96 141.21 47.2 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.126 1.37 . . . . 0.0 107.515 -173.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -145.46 147.52 32.28 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.958 0.903 . . . . 0.0 110.271 -171.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.0 t -134.77 137.32 51.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 105.329 -2.1 . . . . 0.0 105.329 169.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -127.98 133.86 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 105.117 -2.179 . . . . 0.0 105.117 -172.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -154.79 176.35 32.55 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 122.311 0.95 . . . . 0.0 112.695 -178.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.3 m -63.71 129.97 42.3 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 113.798 -1.201 . . . . 0.0 109.225 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -67.23 125.18 25.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -153.79 -175.57 5.43 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.003 0.921 . . . . 0.0 109.442 -169.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.8 -14.16 30.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.629 1.571 . . . . 0.0 112.789 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -144.47 159.24 43.08 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.264 1.026 . . . . 0.0 110.061 174.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.43 -4.16 7.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.056 2.542 . . . . 0.0 109.944 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.2 -31.73 71.49 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.941 1.296 . . . . 0.0 110.722 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.1 ptt? -64.92 -34.34 78.16 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.24 0.927 . . . . 0.0 111.664 173.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -70.11 -46.67 64.35 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.0 mmt -55.61 -40.58 72.29 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.281 174.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.13 74.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.066 0.946 . . . . 0.0 109.896 -178.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.5 t -61.94 -44.12 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-O 118.946 -0.55 . . . . 0.0 110.074 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.67 -46.89 87.8 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.907 0.776 . . . . 0.0 110.665 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -63.8 -45.17 90.88 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 119.04 -0.505 . . . . 0.0 110.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.9 m -60.45 -44.65 95.63 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.154 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.14 -55.72 29.1 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.615 0.643 . . . . 0.0 110.171 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -62.71 -43.95 97.47 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.899 0.38 . . . . 0.0 110.632 -173.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -71.7 -37.02 70.73 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.707 -0.621 . . . . 0.0 111.166 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 t -56.59 -52.38 65.06 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.159 0.984 . . . . 0.0 109.691 174.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 77.1 mt -53.77 -48.44 69.75 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.8 m -56.43 -35.58 68.0 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.613 -0.708 . . . . 0.0 112.332 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -74.59 -47.71 30.89 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.571 1.078 . . . . 0.0 111.233 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 10.2 ptp -69.35 -38.95 78.37 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -169.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.327 2.7 pp -97.26 -5.24 37.24 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -174.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 49.82 30.3 3.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -147.07 179.03 7.9 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.814 1.646 . . . . 0.0 106.879 169.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.87 137.1 57.88 Favored 'General case' 0 C--O 1.23 0.078 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.5 m -76.31 45.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.318 1.847 . . . . 0.0 111.604 -174.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.3 170.15 7.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.84 0.856 . . . . 0.0 111.16 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -54.79 -42.28 71.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.829 -0.545 . . . . 0.0 112.117 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -65.81 -42.49 90.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.485 0.584 . . . . 0.0 109.64 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.23 81.56 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.286 0.494 . . . . 0.0 110.355 -177.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.298 0.0 OUTLIER -74.84 -28.59 60.75 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.073 0.851 . . . . 0.0 111.587 -179.255 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.8 tp -60.89 -39.65 90.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.768 1.167 . . . . 0.0 110.774 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.26 -14.1 62.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.519 0.727 . . . . 0.0 112.179 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -127.75 24.9 6.06 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.267 1.027 . . . . 0.0 111.64 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.29 -45.76 24.43 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.405 1.082 . . . . 0.0 112.29 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.79 -43.53 96.06 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.05 0.841 . . . . 0.0 110.775 -178.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.48 -43.18 99.41 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.7 tp -56.47 -52.43 64.74 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.969 1.308 . . . . 0.0 109.993 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -59.11 -44.84 92.0 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.181 0.446 . . . . 0.0 109.879 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.09 -37.59 86.16 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.804 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.19 91.91 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.981 0.81 . . . . 0.0 110.463 175.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 48.6 t -54.68 -49.04 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -71.6 2.7 4.79 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.016 1.326 . . . . 0.0 113.631 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -119.09 -17.04 9.06 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.533 1.533 . . . . 0.0 111.305 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.33 -46.3 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.25 154.36 30.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.406 1.082 . . . . 0.0 110.8 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -147.3 137.86 23.43 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 125.926 1.69 . . . . 0.0 107.257 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.89 25.48 52.9 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.43 18.09 76.6 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-N 118.149 0.974 . . . . 0.0 113.363 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.6 t -131.8 139.47 50.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 119.343 1.572 . . . . 0.0 107.043 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 18.4 pt -64.07 150.08 10.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 O-C-N 122.147 -0.346 . . . . 0.0 110.667 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -132.79 -14.51 2.77 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.2 1.0 . . . . 0.0 111.928 174.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -149.54 154.07 38.16 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 169.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.4 m -137.12 26.66 2.94 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.561 1.144 . . . . 0.0 110.906 -169.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -143.07 125.74 8.9 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.42 -33.9 10.34 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.295 1.996 . . . . 0.0 111.643 -169.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.86 -40.36 79.38 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -178.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -68.27 -39.84 82.05 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.542 0.61 . . . . 0.0 109.795 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.9 t -55.58 -52.9 42.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 118.741 0.701 . . . . 0.0 109.47 173.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.59 -40.48 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.499 1.045 . . . . 0.0 110.11 -179.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -63.02 -40.21 97.08 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.032 0.833 . . . . 0.0 111.044 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -68.57 -42.32 78.48 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.506 -0.746 . . . . 0.0 110.281 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 53.2 t -57.51 -43.22 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 118.595 0.634 . . . . 0.0 109.409 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.1 -33.58 73.74 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.409 0.684 . . . . 0.0 111.914 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 31.3 mt -72.26 -31.3 65.65 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.197 0.999 . . . . 0.0 112.137 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.967 176.539 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -150.86 170.01 20.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.987 1.315 . . . . 0.0 108.741 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.25 164.56 38.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 125.855 1.662 . . . . 0.0 108.042 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 66.0 tp -53.94 -36.49 62.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 111.857 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.2 pt -128.29 50.5 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 126.565 1.946 . . . . 0.0 108.457 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -54.11 -30.66 49.47 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.751 -0.593 . . . . 0.0 109.861 169.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -141.46 147.73 47.57 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 129.76 3.224 . . . . 0.0 103.06 168.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.84 84.48 0.67 Allowed 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 123.348 2.698 . . . . 0.0 109.55 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.4 m -78.96 1.61 23.14 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.222 1.409 . . . . 0.0 112.368 -170.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -149.14 165.11 32.75 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.299 2.239 . . . . 0.0 108.044 175.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -60.71 135.29 57.72 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 122.764 0.426 . . . . 0.0 110.103 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 34.3 p -80.66 -44.02 19.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 p -122.27 121.57 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.745 1.218 . . . . 0.0 108.037 -169.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -75.06 -42.16 57.51 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 123.655 0.782 . . . . 0.0 109.362 174.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.28 165.72 23.92 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.233 0.47 . . . . 0.0 111.196 -171.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.27 131.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.9 mt -130.41 148.16 52.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mt -138.54 118.84 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 173.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.7 mt -122.68 143.04 50.04 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -175.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.41 167.79 13.96 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 169.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -57.29 -22.03 38.94 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.67 -25.5 20.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.727 1.149 . . . . 0.0 111.305 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.81 6.97 5.79 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 126.046 1.784 . . . . 0.0 112.557 173.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.29 129.48 40.02 Favored 'General case' 0 C--N 1.338 0.075 0 CA-C-N 119.088 1.444 . . . . 0.0 109.789 -178.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -66.32 94.59 0.27 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 109.288 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -50.87 61.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 168.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -148.78 153.09 37.66 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -156.87 147.55 21.58 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 169.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.445 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.7 OUTLIER -143.51 147.89 35.17 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.077 1.351 . . . . 0.0 107.504 169.913 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -137.73 143.76 41.36 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.91 1.684 . . . . 0.0 106.482 -175.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.06 -2.99 5.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.262 1.025 . . . . 0.0 112.621 -173.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -131.04 162.71 29.21 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.842 0.746 . . . . 0.0 109.08 -177.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -71.72 7.27 1.56 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.833 2.053 . . . . 0.0 112.505 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 p -61.68 -52.7 63.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.46 1.504 . . . . 0.0 110.207 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -144.29 70.75 16.12 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 124.64 1.176 . . . . 0.0 109.039 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.02 -1.62 9.43 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 122.667 2.245 . . . . 0.0 113.69 -172.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 m -136.49 139.38 42.26 Favored 'General case' 0 C--N 1.34 0.174 0 C-N-CA 123.971 0.908 . . . . 0.0 109.773 -169.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.5 t -46.42 -49.1 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 126.066 1.746 . . . . 0.0 113.025 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -58.47 -43.31 88.85 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.722 0.692 . . . . 0.0 111.406 -176.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.14 -32.18 58.98 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.856 0.298 . . . . 0.0 110.299 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -62.48 -48.73 78.32 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.252 0.621 . . . . 0.0 110.231 175.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -59.79 -35.71 75.23 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.983 0.811 . . . . 0.0 111.178 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.05 -44.86 75.43 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.02 0.528 . . . . 0.0 109.961 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.77 -38.35 90.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.077 0.551 . . . . 0.0 111.005 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.75 -41.25 96.06 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.701 1.6 . . . . 0.0 110.872 177.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.3 mmtt -60.34 -45.9 91.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.708 -0.62 . . . . 0.0 109.769 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.2 -48.12 77.04 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.431 0.692 . . . . 0.0 111.176 174.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mm -56.68 -54.07 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 C-N-CA 124.41 1.084 . . . . 0.0 108.546 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -60.28 -48.99 79.37 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.174 0.59 . . . . 0.0 109.926 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -60.37 -39.66 88.02 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.517 1.127 . . . . 0.0 112.692 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt -73.37 -50.04 24.04 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 121.645 -0.659 . . . . 0.0 109.344 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.409 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 33.1 p -70.39 -31.87 69.28 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -69.11 -5.37 21.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.938 0.79 . . . . 0.0 112.527 173.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtp-105 -126.78 28.27 5.89 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.388 1.875 . . . . 0.0 109.353 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 99.4 m -134.47 158.17 44.59 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.913 1.685 . . . . 0.0 108.048 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 29.05 0.46 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.542 1.537 . . . . 0.0 113.324 -169.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m 67.81 -179.53 0.22 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.016 1.726 . . . . 0.0 113.319 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.7 pt-20 56.62 -43.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 131.362 3.865 . . . . 0.0 117.006 -176.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.6 tt -154.89 155.25 6.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 120.21 1.368 . . . . 0.0 109.772 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.5 172.69 14.08 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.487 1.915 . . . . 0.0 108.389 172.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -134.43 121.24 20.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 103.64 -2.726 . . . . 0.0 103.64 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.2 mt -78.14 -69.08 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.062 -168.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -142.53 7.9 1.74 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.548 1.939 . . . . 0.0 110.281 -176.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.82 -43.73 0.78 Allowed Glycine 0 CA--C 1.525 0.662 0 C-N-CA 126.241 1.877 . . . . 0.0 108.703 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.6 mt -68.49 129.31 39.56 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.826 0.85 . . . . 0.0 109.889 174.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 85.3 m -78.76 148.13 33.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.4 p -140.13 130.9 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 171.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -101.3 144.8 12.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 25.7 p90 -160.11 162.16 33.97 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.004 0.366 . . . . 0.0 111.61 -175.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -154.46 -179.85 8.34 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 169.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -135.26 149.24 49.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 123.885 0.874 . . . . 0.0 109.094 170.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -146.44 142.2 27.9 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.3 mt 61.68 -84.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 126.703 2.001 . . . . 0.0 110.85 174.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -148.99 25.77 0.91 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.236 2.614 . . . . 0.0 109.737 -176.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.27 150.48 51.49 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.194 2.198 . . . . 0.0 109.581 -169.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -130.35 143.62 50.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.53 1.532 . . . . 0.0 107.582 170.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -135.89 137.42 41.41 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.801 1.24 . . . . 0.0 107.669 -170.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -144.08 144.6 31.69 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 -171.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 62.0 t -135.74 121.79 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.39 134.29 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 -173.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -149.42 172.39 29.44 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 122.005 0.781 . . . . 0.0 113.325 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.5 m -64.72 164.16 12.65 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.466 -1.367 . . . . 0.0 109.277 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.9 m -129.01 29.12 5.24 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.915 0.886 . . . . 0.0 110.752 -169.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 38.8 p90 -61.69 -34.56 75.96 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.873 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -160.72 -33.31 0.05 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.484 0.584 . . . . 0.0 112.418 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.24 171.77 14.45 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.693 0.797 . . . . 0.0 111.487 -170.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.1 -2.5 2.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.888 2.475 . . . . 0.0 110.69 -174.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -66.16 -33.61 76.17 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 124.266 1.026 . . . . 0.0 110.714 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -32.49 74.08 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.643 0.656 . . . . 0.0 111.253 173.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.8 mt -70.25 -43.64 70.11 Favored 'General case' 0 C--O 1.23 0.067 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.8 mmt -55.82 -40.89 73.41 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.064 173.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -47.87 78.7 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.121 0.568 . . . . 0.0 110.468 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.25 -46.92 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.696 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 60.4 tp -60.07 -45.65 92.2 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.575 0.625 . . . . 0.0 110.514 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -63.24 -47.08 83.98 Favored 'General case' 0 C--N 1.338 0.094 0 CA-C-O 119.146 -0.455 . . . . 0.0 110.237 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.7 m -61.55 -44.66 96.63 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.192 0.451 . . . . 0.0 110.389 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.6 tp -60.5 -53.57 55.88 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.887 0.875 . . . . 0.0 110.791 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.82 -41.41 97.86 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.684 0.278 . . . . 0.0 110.908 -177.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -75.03 -31.81 61.42 Favored 'General case' 0 N--CA 1.456 -0.141 0 O-C-N 121.51 -0.744 . . . . 0.0 111.294 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -62.67 -47.75 82.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.916 0.78 . . . . 0.0 110.023 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.5 mt -51.7 -51.42 56.16 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -34.12 69.77 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -71.67 -41.55 68.56 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.645 1.111 . . . . 0.0 111.437 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -97.85 3.36 49.85 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -171.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.8 tp -141.32 58.19 1.52 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.208 1.803 . . . . 0.0 107.902 -172.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -69.54 49.83 0.09 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.49 2.316 . . . . 0.0 112.9 -171.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.7 pttt -137.55 -67.86 0.48 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.848 1.259 . . . . 0.0 109.318 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -159.45 149.19 18.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 174.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.5 m -90.91 50.42 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-O 121.809 0.814 . . . . 0.0 109.71 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.95 167.9 11.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.872 1.269 . . . . 0.0 111.275 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -49.15 -54.66 15.33 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.155 1.382 . . . . 0.0 112.743 -171.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -62.04 -42.64 99.4 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 122.462 0.305 . . . . 0.0 110.499 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.49 -38.58 87.56 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.388 0.54 . . . . 0.0 110.582 -177.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.79 -45.37 92.96 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 121.421 -0.799 . . . . 0.0 110.207 174.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 68.6 tp -57.28 -38.25 73.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.288 0.635 . . . . 0.0 111.322 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -71.5 -16.99 62.37 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.92 23.54 4.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.404 1.002 . . . . 0.0 112.685 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -37.41 -50.09 1.05 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.334 1.854 . . . . 0.0 113.179 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -62.12 -40.3 95.44 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.539 1.063 . . . . 0.0 111.377 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.76 -45.86 94.86 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 177.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.75 -51.08 71.48 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.021 0.928 . . . . 0.0 110.747 175.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -54.43 -48.39 71.73 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 109.6 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.78 -33.31 66.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.434 -175.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.84 -44.48 96.02 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 119.37 0.987 . . . . 0.0 109.843 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -58.04 -45.77 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.448 0.567 . . . . 0.0 109.482 175.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -3.02 6.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.687 1.195 . . . . 0.0 113.506 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -115.29 -17.97 11.19 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.222 1.409 . . . . 0.0 111.745 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 55.6 mt -86.1 -30.35 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.265 1.026 . . . . 0.0 109.179 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.6 t -139.97 147.59 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 125.245 1.418 . . . . 0.0 107.938 -170.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -143.31 130.84 21.16 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.86 1.264 . . . . 0.0 107.646 170.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.9 52.1 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.538 175.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.01 16.45 79.5 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-N 118.225 1.012 . . . . 0.0 113.684 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 57.4 t -127.87 142.32 44.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 44.2 pt -54.53 142.9 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.526 0.679 . . . . 0.0 110.562 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.53 -42.3 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.996 1.718 . . . . 0.0 108.317 -175.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -144.86 156.42 44.0 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.135 0.974 . . . . 0.0 108.716 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -135.29 24.92 3.51 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.152 1.381 . . . . 0.0 110.49 -172.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -141.84 118.1 7.18 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 124.377 1.071 . . . . 0.0 108.87 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 -32.57 11.59 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.701 2.267 . . . . 0.0 111.79 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.19 -40.44 86.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -69.63 -36.55 76.24 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.816 0.735 . . . . 0.0 110.298 177.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.7 t -56.78 -55.68 18.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 123.236 0.614 . . . . 0.0 109.396 175.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 34.1 m -67.18 -30.14 48.32 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 CA-C-N 119.2 0.909 . . . . 0.0 111.287 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.54 -51.88 67.56 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.017 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -62.53 -40.77 97.83 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.73 1.15 . . . . 0.0 110.844 178.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 t -56.66 -45.93 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.104 0.411 . . . . 0.0 110.384 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -79.62 -26.52 41.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.026 0.83 . . . . 0.0 111.452 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 63.7 tp -71.88 -22.29 61.53 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.396 1.879 . . . . 0.0 112.1 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.0 ptt-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.083 1.353 . . . . 0.0 113.167 178.632 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -159.83 -177.81 6.61 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.046 1.738 . . . . 0.0 108.032 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -146.42 167.49 23.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.22 1.408 . . . . 0.0 109.153 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.02 -27.03 68.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.536 0.734 . . . . 0.0 111.94 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.2 mt -127.73 54.92 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -54.11 -36.42 63.2 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.932 0.893 . . . . 0.0 109.808 174.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -134.19 141.36 39.11 Favored Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 169.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.42 -4.08 13.09 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.795 2.997 . . . . 0.0 112.881 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -53.7 -27.7 29.58 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.327 1.451 . . . . 0.0 112.243 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 26.13 81.61 0.01 OUTLIER 'General case' 0 C--N 1.348 0.503 0 C-N-CA 129.085 2.954 . . . . 0.0 113.002 173.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -63.55 115.16 4.42 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.7 p -66.85 -26.83 67.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 109.993 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -135.6 141.1 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -100.06 -27.34 13.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 117.682 -1.152 . . . . 0.0 109.723 173.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.27 166.09 28.19 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.56 1.073 . . . . 0.0 111.916 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.9 mt -134.01 137.19 52.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -134.11 150.79 51.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 61.0 mt -137.69 114.35 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 102.925 -2.991 . . . . 0.0 102.925 169.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 46.2 mt -117.29 147.78 42.27 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 122.238 1.018 . . . . 0.0 110.164 -169.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -68.85 172.55 6.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 113.449 -1.705 . . . . 0.0 107.928 169.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -78.08 35.6 0.21 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.05 2.14 . . . . 0.0 111.126 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -149.09 8.1 0.73 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.696 2.398 . . . . 0.0 110.838 178.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.11 47.91 69.29 Favored Glycine 0 C--N 1.342 0.872 0 O-C-N 120.883 -1.136 . . . . 0.0 110.767 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -123.97 126.7 46.77 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 118.013 0.906 . . . . 0.0 108.846 -178.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -60.61 107.98 0.76 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.78 0.832 . . . . 0.0 110.888 -177.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -74.12 -41.59 61.37 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 155.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -141.14 149.1 41.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.081 1.352 . . . . 0.0 108.208 171.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.55 144.02 16.55 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.461 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -148.23 147.63 29.59 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.013 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -135.49 149.11 49.44 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.624 1.57 . . . . 0.0 106.978 -176.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -133.54 -1.36 3.14 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.974 0.91 . . . . 0.0 111.92 -174.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -135.05 159.4 41.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.927 0.785 . . . . 0.0 110.036 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -73.53 2.28 8.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.021 2.129 . . . . 0.0 113.043 -169.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -59.64 -47.54 85.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.337 1.055 . . . . 0.0 110.724 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -144.87 79.38 12.11 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.53 1.132 . . . . 0.0 108.261 -177.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -92.67 -0.6 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.864 2.376 . . . . 0.0 113.504 -174.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 m -134.31 138.05 44.67 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.131 0.972 . . . . 0.0 109.814 -169.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.24 -44.85 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.257 1.423 . . . . 0.0 113.532 -169.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -61.14 -44.62 97.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 117.959 0.345 . . . . 0.0 110.646 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -78.9 -32.51 45.78 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.66 -50.1 73.86 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.355 0.525 . . . . 0.0 110.455 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -62.39 -33.46 74.8 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.064 -1.023 . . . . 0.0 111.153 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.5 73.69 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.946 -0.471 . . . . 0.0 109.866 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.17 -37.96 81.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.657 0.783 . . . . 0.0 110.699 175.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -63.33 -42.81 98.99 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.793 1.637 . . . . 0.0 110.997 176.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -61.36 -44.65 96.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.164 0.893 . . . . 0.0 110.447 172.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.407 HD22 ' CD2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -58.15 -45.48 87.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.077 0.551 . . . . 0.0 111.198 177.28 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.1 mm -58.28 -53.91 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.377 1.071 . . . . 0.0 108.394 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.19 -43.74 95.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.73 0.412 . . . . 0.0 110.813 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -56.03 -48.24 76.33 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.347 0.659 . . . . 0.0 110.641 174.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -61.67 -50.66 71.6 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 118.107 0.412 . . . . 0.0 109.925 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.9 p -71.74 -31.16 66.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.925 0.784 . . . . 0.0 111.801 -171.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -62.88 -16.53 59.16 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.718 0.69 . . . . 0.0 111.467 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -117.95 25.0 10.66 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.093 1.757 . . . . 0.0 109.814 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.8 m -133.52 158.54 42.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.312 1.845 . . . . 0.0 107.554 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.97 -48.15 80.09 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 118.443 -0.789 . . . . 0.0 112.371 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.0 m 153.91 -175.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 131.768 4.027 . . . . 0.0 108.192 -177.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.2 pt-20 59.62 -43.4 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 131.486 3.914 . . . . 0.0 117.427 173.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.9 tt -155.3 153.01 8.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 120.729 1.604 . . . . 0.0 110.024 -176.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.06 172.24 14.57 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 126.038 1.735 . . . . 0.0 108.429 170.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.5 tp -140.8 116.18 10.05 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.407 ' CD2' HD22 ' A' ' 47' ' ' ASN . 8.7 mp -84.65 -155.85 0.22 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.447 1.499 . . . . 0.0 108.912 178.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.61 15.63 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.187 2.595 . . . . 0.0 114.205 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.55 -10.54 1.28 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 126.004 1.764 . . . . 0.0 112.1 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.2 mt -112.88 119.8 39.24 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.358 1.079 . . . . 0.0 109.319 -171.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.2 m -72.69 144.34 47.74 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 171.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 3.9 p -136.97 134.34 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.45 137.99 45.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -154.69 166.63 32.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 120.595 0.235 . . . . 0.0 111.027 -169.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -152.05 175.91 12.06 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 123.763 0.825 . . . . 0.0 108.913 169.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 m -141.15 133.4 28.07 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -144.46 145.75 32.07 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.48 0.712 . . . . 0.0 109.957 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.8 mp 49.31 -86.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.971 2.108 . . . . 0.0 111.614 -171.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -149.06 28.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.961 2.104 . . . . 0.0 108.978 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.5 tp -132.96 144.66 50.27 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.529 1.532 . . . . 0.0 109.198 -169.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -125.78 137.44 53.79 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -129.13 141.36 51.21 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.646 1.178 . . . . 0.0 108.214 -171.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -147.23 148.54 31.58 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.809 0.844 . . . . 0.0 110.866 -169.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.5 t -135.84 125.71 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 170.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.3 mp -114.78 137.67 47.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 -177.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.33 178.41 35.48 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-O 122.519 1.066 . . . . 0.0 113.294 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.9 m -65.27 133.84 52.33 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 112.972 -1.614 . . . . 0.0 107.798 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 m -78.56 48.17 0.77 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.836 1.254 . . . . 0.0 110.831 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -72.55 64.97 0.64 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.041 2.537 . . . . 0.0 110.617 -174.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 54.53 14.19 0.79 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.393 2.277 . . . . 0.0 113.754 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.76 160.67 25.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 126.833 2.053 . . . . 0.0 107.48 -171.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.98 -5.64 1.89 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.062 2.145 . . . . 0.0 110.047 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -61.25 -34.42 75.12 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.447 1.099 . . . . 0.0 110.671 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.38 -33.91 76.94 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.022 0.828 . . . . 0.0 112.054 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.5 mt -71.77 -41.91 67.82 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.1 mtp -60.29 -37.06 79.35 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.714 173.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.01 63.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.713 0.805 . . . . 0.0 109.851 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -61.56 -44.91 99.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 118.237 0.471 . . . . 0.0 109.869 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.89 -51.44 69.6 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 123.261 0.624 . . . . 0.0 109.744 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -62.16 -45.57 92.81 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.631 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 85.8 m -60.99 -42.81 99.14 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.083 0.856 . . . . 0.0 111.073 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.4 tp -68.56 -48.18 64.93 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.92 0.782 . . . . 0.0 110.794 -177.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -64.15 -40.29 95.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.941 -0.475 . . . . 0.0 110.824 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -77.21 -33.8 56.19 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.239 -0.913 . . . . 0.0 111.624 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.5 p -64.86 -42.26 95.01 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.729 1.15 . . . . 0.0 109.85 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.5 mt -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -61.13 -13.59 18.64 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -94.9 -37.75 11.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 120.611 1.55 . . . . 0.0 112.111 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -97.92 -0.95 43.95 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.0 tp -134.99 52.64 2.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.981 1.712 . . . . 0.0 109.206 -171.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -68.73 61.9 0.1 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.77 2.028 . . . . 0.0 112.627 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.402 ' HG3' ' H ' ' A' ' 108' ' ' ASN . 15.0 ptmt -138.29 -66.58 0.49 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.319 1.848 . . . . 0.0 106.952 169.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.402 ' H ' ' HG3' ' A' ' 107' ' ' LYS . 5.8 m-20 -163.6 150.04 11.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 129.102 2.961 . . . . 0.0 103.354 169.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.61 40.89 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 118.829 0.74 . . . . 0.0 109.962 171.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -86.2 172.74 10.29 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.242 1.017 . . . . 0.0 111.912 -173.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -54.81 -53.59 53.26 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 124.525 1.13 . . . . 0.0 112.51 -172.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.0 mmt180 -65.0 -39.23 93.15 Favored 'General case' 0 N--CA 1.463 0.202 0 O-C-N 121.979 -0.451 . . . . 0.0 110.19 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.53 -39.87 94.57 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.194 0.452 . . . . 0.0 111.228 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.303 0.0 OUTLIER -76.43 -29.78 57.14 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.98 -1.075 . . . . 0.0 110.864 178.39 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.6 tp -60.78 -36.14 78.25 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.726 0.694 . . . . 0.0 111.188 169.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -65.86 -25.72 67.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.679 -0.638 . . . . 0.0 112.711 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -131.01 31.9 4.39 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.823 0.849 . . . . 0.0 112.607 -173.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -39.18 -48.53 1.76 Allowed 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.816 1.646 . . . . 0.0 112.585 175.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -67.34 -35.45 79.4 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.676 0.671 . . . . 0.0 111.883 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.72 -42.53 99.76 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 172.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.75 -45.94 92.37 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.052 0.941 . . . . 0.0 111.23 173.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -54.99 -47.04 75.15 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.318 0.963 . . . . 0.0 109.788 175.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.3 mt -67.44 -32.8 73.91 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.673 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.59 -45.64 86.1 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.086 0.857 . . . . 0.0 110.151 174.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.33 -41.55 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 118.57 0.623 . . . . 0.0 109.924 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.91 -24.04 63.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.213 1.005 . . . . 0.0 112.574 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -91.85 -41.76 10.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.586 0.63 . . . . 0.0 110.927 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.65 -38.07 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 118.814 0.734 . . . . 0.0 109.481 -177.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.6 t -131.14 144.87 36.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.371 1.068 . . . . 0.0 109.21 -171.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -142.07 126.26 17.47 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 124.869 1.268 . . . . 0.0 107.687 169.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.92 30.29 59.97 Favored Glycine 0 CA--C 1.534 1.222 0 CA-C-O 119.361 -0.688 . . . . 0.0 113.35 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.32 12.21 84.79 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.335 1.067 . . . . 0.0 113.554 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.2 t -120.61 139.83 46.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 177.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.7 pt -56.4 138.82 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.196 0.522 . . . . 0.0 110.066 173.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -127.46 -35.62 2.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.581 1.553 . . . . 0.0 109.409 -171.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -138.93 151.64 47.07 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.5 m -139.24 29.25 2.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.776 1.231 . . . . 0.0 110.822 -169.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -137.98 121.69 11.57 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.31 -34.95 9.12 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.702 2.268 . . . . 0.0 113.634 -171.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -73.55 -38.35 65.27 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.162 0.892 . . . . 0.0 109.835 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -63.2 -37.23 86.41 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.167 0.894 . . . . 0.0 110.409 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.24 -53.52 38.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.686 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 26.3 m -66.5 -33.53 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 121.109 1.777 . . . . 0.0 112.263 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -61.6 -48.72 79.66 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.176 0.898 . . . . 0.0 109.554 177.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -70.21 -34.34 72.79 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.398 -0.814 . . . . 0.0 111.101 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 3.5 t -57.72 -45.77 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 121.394 -0.816 . . . . 0.0 109.633 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.05 -28.0 57.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 122.218 -0.301 . . . . 0.0 111.637 -175.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 54.3 mt -74.89 -26.57 59.75 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.286 1.034 . . . . 0.0 112.13 175.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 C--O 1.249 1.073 0 CA-C-N 119.14 0.882 . . . . 0.0 110.09 171.18 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.238 0.464 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.4 p -67.29 -33.46 75.35 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.33 128.05 57.96 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 169.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.45 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 23.6 mtpp -86.5 -30.3 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 118.201 -0.904 . . . . 0.0 108.747 174.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.38 167.56 27.09 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 119.222 0.919 . . . . 0.0 111.564 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.2 mt -136.47 131.42 48.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.8 mt -131.82 148.55 52.56 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mt -140.58 120.28 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 173.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 mt -124.15 147.13 48.2 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.69 169.41 11.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 169.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.7 -18.82 56.5 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.18 -23.03 18.71 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.452 1.024 . . . . 0.0 110.865 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.75 7.45 6.13 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.652 1.596 . . . . 0.0 112.435 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -68.01 130.09 41.91 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 119.355 1.578 . . . . 0.0 109.891 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -67.58 94.49 0.42 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.719 1.207 . . . . 0.0 109.838 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.3 mt -71.32 -47.75 54.71 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -147.01 152.44 38.6 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.384 0.674 . . . . 0.0 109.378 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.22 147.04 19.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 169.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 1.0 OUTLIER -145.41 147.89 32.72 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 169.76 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -136.73 147.23 46.61 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.816 1.646 . . . . 0.0 106.756 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -133.73 8.3 3.85 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.662 1.185 . . . . 0.0 110.929 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -136.12 148.3 48.17 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.725 0.81 . . . . 0.0 111.298 -169.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.84 -9.01 49.01 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.893 1.677 . . . . 0.0 114.002 -172.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 p -62.86 -40.84 98.71 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.093 -1.004 . . . . 0.0 112.136 176.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -141.77 64.96 19.17 Favored Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 118.951 0.796 . . . . 0.0 110.863 -173.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -86.52 -1.32 8.32 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.817 2.345 . . . . 0.0 113.451 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.6 m -134.98 140.21 45.5 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.028 0.931 . . . . 0.0 109.676 -169.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -45.2 -51.06 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 126.353 1.861 . . . . 0.0 113.01 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -59.05 -43.81 91.74 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.481 0.582 . . . . 0.0 111.201 -175.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.45 -33.59 62.96 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -61.38 -48.91 79.08 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.499 0.72 . . . . 0.0 110.15 174.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.36 -35.81 74.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.207 0.912 . . . . 0.0 111.488 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.78 -48.61 73.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -63.45 -38.0 89.45 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.011 0.524 . . . . 0.0 111.123 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.01 -41.63 97.4 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.758 1.623 . . . . 0.0 111.258 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.03 -38.93 79.45 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 121.576 -0.702 . . . . 0.0 110.12 176.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.6 -51.07 68.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.908 -0.568 . . . . 0.0 110.343 169.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.1 mm -53.55 -55.06 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 124.987 1.315 . . . . 0.0 108.001 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -59.41 -48.05 83.13 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.789 0.436 . . . . 0.0 110.898 -175.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -58.65 -45.96 88.2 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.732 -0.605 . . . . 0.0 111.225 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -71.15 -6.1 36.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 117.596 -1.192 . . . . 0.0 113.167 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.7 p -125.11 -37.25 2.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 120.862 1.664 . . . . 0.0 113.479 -169.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -70.17 -0.35 7.67 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 120.321 1.419 . . . . 0.0 112.622 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -123.27 20.58 9.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.769 2.028 . . . . 0.0 110.009 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 98.3 m -138.26 160.06 40.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.083 1.353 . . . . 0.0 109.33 -169.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.21 85.51 4.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.537 1.135 . . . . 0.0 109.627 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.4 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 4.0 m -46.8 139.28 5.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.402 1.881 . . . . 0.0 115.779 -170.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 152.02 -37.49 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.321 1 C-N-CA 132.387 4.275 . . . . 0.0 107.521 170.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.31 155.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.462 1.105 . . . . 0.0 109.306 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.0 173.88 13.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.47 1.908 . . . . 0.0 108.324 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.0 tp -139.29 115.6 10.46 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.089 -2.189 . . . . 0.0 105.089 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.79 143.26 29.57 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.859 0.864 . . . . 0.0 109.848 -169.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 50.33 26.1 2.13 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.816 1.246 . . . . 0.0 112.721 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.68 9.98 82.18 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.054 1.312 . . . . 0.0 114.112 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.4 mt -123.81 130.88 53.32 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 126.093 1.757 . . . . 0.0 109.718 -172.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 m -74.49 142.19 44.85 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.88 132.61 34.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -101.61 149.84 6.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 33.5 p90 -154.67 163.83 39.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.575 0.702 . . . . 0.0 111.859 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -150.95 155.98 40.23 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.901 2.08 . . . . 0.0 106.184 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 m -140.06 143.94 36.59 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.4 m -145.16 128.58 16.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.795 0.838 . . . . 0.0 110.589 169.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.3 mt 57.59 -69.27 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 128.089 2.556 . . . . 0.0 114.783 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -146.09 19.84 1.41 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.208 2.203 . . . . 0.0 109.327 -171.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -138.73 147.01 42.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.471 1.508 . . . . 0.0 110.558 -168.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -132.97 141.35 48.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.694 1.598 . . . . 0.0 106.97 169.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -128.35 136.83 51.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.9 1.68 . . . . 0.0 107.038 -172.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -143.14 145.84 33.19 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.116 0.871 . . . . 0.0 110.478 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.8 t -136.74 127.88 41.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.72 136.15 59.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.45 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -157.87 -173.72 26.65 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 121.942 0.746 . . . . 0.0 112.394 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -67.84 171.22 6.85 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 113.824 -1.188 . . . . 0.0 110.041 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.3 m -130.21 28.52 4.99 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.465 1.106 . . . . 0.0 110.512 -171.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -59.24 -52.41 65.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.508 0.723 . . . . 0.0 112.324 -169.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -148.62 -12.87 0.34 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -153.28 164.96 37.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.788 1.176 . . . . 0.0 111.615 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.23 -3.58 5.61 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 127.699 2.4 . . . . 0.0 110.243 174.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.43 -32.96 74.8 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.37 1.068 . . . . 0.0 110.976 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.6 ptt? -64.05 -33.66 76.25 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.901 0.773 . . . . 0.0 111.638 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.7 mt -71.25 -45.99 62.0 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 10.1 mmt -54.67 -41.18 69.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.288 0.635 . . . . 0.0 110.433 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.43 -51.05 67.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 118.794 0.724 . . . . 0.0 110.129 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 53.3 t -62.29 -44.27 98.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 118.89 -0.576 . . . . 0.0 110.004 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 63.2 tp -62.09 -45.31 94.09 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.875 0.762 . . . . 0.0 110.781 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.5 t -59.51 -46.05 89.95 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.66 -51.52 66.9 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.604 1.161 . . . . 0.0 111.861 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -64.61 -40.82 96.18 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.183 -0.323 . . . . 0.0 110.65 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -75.15 -38.37 60.98 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.344 -0.848 . . . . 0.0 111.534 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 21.9 p -63.99 -41.33 97.54 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 119.352 0.978 . . . . 0.0 110.686 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.8 mt -53.88 -51.02 64.99 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 169.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.6 m -54.83 -36.53 65.1 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 118.633 -0.698 . . . . 0.0 112.008 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.466 ' HB2' HG21 ' A' ' 143' ' ' VAL . 48.4 mm-40 -72.5 -51.34 20.47 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.516 1.053 . . . . 0.0 111.634 176.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 58.5 mtm -69.16 -41.02 77.83 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.035 0.834 . . . . 0.0 110.298 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.8 mp -74.16 -31.41 62.69 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.775 0.83 . . . . 0.0 110.27 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 42.77 45.93 4.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.466 1.907 . . . . 0.0 111.258 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mmmt -145.9 -176.32 5.09 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 128.667 2.787 . . . . 0.0 106.868 -173.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.4 17.8 2.02 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.678 0.791 . . . . 0.0 111.396 -175.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.315 5.8 m 45.26 39.12 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 126.948 2.099 . . . . 0.0 111.949 -173.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -78.17 174.17 11.46 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.64 1.176 . . . . 0.0 110.897 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -50.66 67.73 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.066 0.946 . . . . 0.0 112.475 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -65.63 -38.71 90.17 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.199 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.84 -39.76 92.94 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.9 0.773 . . . . 0.0 110.624 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.26 -46.08 78.29 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.737 0.699 . . . . 0.0 111.047 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.9 tp -58.15 -38.64 76.99 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.966 0.507 . . . . 0.0 110.946 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -68.46 -16.97 64.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.251 1.02 . . . . 0.0 113.137 176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -132.52 22.51 4.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.295 0.952 . . . . 0.0 112.214 -169.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -45.0 -45.69 10.77 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.133 1.373 . . . . 0.0 111.905 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.34 -42.35 96.31 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.005 0.82 . . . . 0.0 111.371 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.33 -44.29 98.26 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.3 tp -57.46 -51.04 71.05 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.218 1.007 . . . . 0.0 110.709 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -56.21 -47.32 78.63 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.347 0.521 . . . . 0.0 109.773 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.8 mt -69.63 -30.78 68.58 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.043 -0.503 . . . . 0.0 111.781 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.92 -46.4 78.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.131 0.878 . . . . 0.0 109.706 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.6 t -57.87 -40.65 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.449 0.568 . . . . 0.0 109.77 176.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -63.0 -8.35 7.11 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.28 1.432 . . . . 0.0 113.905 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.27 -31.67 5.9 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.686 1.195 . . . . 0.0 111.723 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 72.6 mt -66.27 -41.08 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 109.085 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.5 m -140.38 160.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.327 1.051 . . . . 0.0 109.875 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -148.6 127.57 12.73 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.197 1.399 . . . . 0.0 107.671 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.16 31.53 56.35 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.34 -0.7 . . . . 0.0 113.434 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.6 11.21 85.5 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.2 1.0 . . . . 0.0 113.823 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -117.61 137.27 52.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 pt -55.14 138.03 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.321 0.581 . . . . 0.0 110.33 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -126.11 -39.97 2.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.41 1.484 . . . . 0.0 108.838 -172.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -145.26 150.82 37.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.57 0.623 . . . . 0.0 109.386 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.4 m -135.05 24.63 3.58 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.902 1.281 . . . . 0.0 111.144 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -128.71 118.77 19.97 Favored Pre-proline 0 C--O 1.236 0.375 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.19 -42.57 2.86 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 121.743 1.629 . . . . 0.0 112.255 -169.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.3 pp0? -70.51 -26.06 63.42 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.555 1.07 . . . . 0.0 110.776 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.41 -45.08 70.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.652 1.115 . . . . 0.0 109.975 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 16.6 t -52.6 -48.91 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.466 HG21 ' HB2' ' A' ' 103' ' ' GLN . 79.6 t -60.9 -41.53 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-O 118.201 -0.905 . . . . 0.0 111.014 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -57.62 -46.9 83.54 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.618 1.099 . . . . 0.0 109.448 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -65.14 -40.3 94.24 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.638 -0.664 . . . . 0.0 111.466 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 96.6 t -63.81 -43.55 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 118.811 0.732 . . . . 0.0 109.555 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.93 -35.74 80.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.02 0.528 . . . . 0.0 111.086 -178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.0 mt -76.66 -28.39 55.97 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.706 1.202 . . . . 0.0 112.519 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 . . . . . 0 C--O 1.25 1.086 0 CA-C-N 118.921 0.782 . . . . 0.0 110.187 172.365 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.234 0.265 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.6 p -71.78 -42.5 67.06 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 81.4 t -123.07 118.59 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -83.39 -33.99 25.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.13 175.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.89 167.27 24.97 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.412 1.005 . . . . 0.0 111.255 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -135.4 133.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 mt -132.98 146.77 52.07 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.557 ' CG2' HD11 ' A' ' 75' ' ' LEU . 54.2 mt -136.67 116.31 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 169.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.79 147.9 47.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.593 0.711 . . . . 0.0 110.486 -169.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -66.35 171.64 4.67 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.882 169.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 21.18 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.857 2.063 . . . . 0.0 114.111 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -136.45 11.48 3.23 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.469 1.908 . . . . 0.0 110.602 172.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.98 35.51 71.95 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 120.825 -1.172 . . . . 0.0 111.296 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -104.23 132.53 50.38 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.421 1.111 . . . . 0.0 109.29 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -58.87 114.88 2.76 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.834 0.854 . . . . 0.0 110.404 -174.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.5 mt -91.17 -42.66 10.32 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 156.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -145.47 149.03 33.92 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 169.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.12 144.25 12.8 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 168.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? -145.67 147.19 31.72 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.066 1.346 . . . . 0.0 107.689 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -132.19 150.44 52.15 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.834 1.654 . . . . 0.0 107.272 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -133.59 9.61 3.97 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.332 1.453 . . . . 0.0 110.597 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -129.2 150.18 50.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.283 1.433 . . . . 0.0 108.871 -169.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.16 -1.32 56.76 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.215 1.006 . . . . 0.0 112.98 -169.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 m -70.47 -34.32 72.26 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.683 0.674 . . . . 0.0 110.763 175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -140.56 67.23 30.05 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.058 0.943 . . . . 0.0 110.133 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -90.15 -2.71 5.42 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.705 2.27 . . . . 0.0 113.458 -174.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.4 m -135.45 145.75 47.52 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.003 0.921 . . . . 0.0 109.757 -169.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.5 t -45.54 -52.35 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 126.178 1.791 . . . . 0.0 113.036 -169.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.53 -45.5 88.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.755 0.707 . . . . 0.0 111.06 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.4 -35.06 65.8 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -177.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -61.12 -50.21 74.12 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.772 0.829 . . . . 0.0 110.047 174.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -60.14 -36.21 77.02 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.282 -0.886 . . . . 0.0 111.385 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.05 -47.64 76.63 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.09 0.556 . . . . 0.0 109.65 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -61.47 -37.66 84.43 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.432 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.2 -37.34 87.0 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.188 1.395 . . . . 0.0 112.042 176.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.92 -47.45 80.5 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.394 0.997 . . . . 0.0 109.236 172.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.31 -50.95 66.17 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.366 0.417 . . . . 0.0 110.551 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.5 -55.66 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 125.408 1.483 . . . . 0.0 108.415 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -66.8 -43.79 82.97 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 117.995 0.361 . . . . 0.0 110.782 -172.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.93 -50.39 70.86 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.59 0.356 . . . . 0.0 110.31 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.1 mmtm -66.16 -50.18 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 122.278 0.231 . . . . 0.0 110.531 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 38.4 p -70.82 -35.67 72.59 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -168.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.9 p-80 -71.08 -1.42 12.2 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 120.359 1.436 . . . . 0.0 112.266 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -122.72 23.16 9.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.57 1.948 . . . . 0.0 109.726 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.2 m -132.94 160.01 38.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.977 1.711 . . . . 0.0 108.268 -177.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -80.99 28.88 0.35 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.754 1.621 . . . . 0.0 113.282 -169.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.454 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 3.9 m 67.69 -177.62 0.21 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.168 1.787 . . . . 0.0 113.725 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 10.6 pt-20 57.91 -46.01 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 131.522 3.929 . . . . 0.0 117.078 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.4 tt -152.88 154.64 7.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 120.461 1.482 . . . . 0.0 109.785 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.11 174.08 13.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.65 1.58 . . . . 0.0 109.01 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.37 105.73 6.38 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 178.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.8 mt -127.84 132.56 49.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 52.98 26.58 4.83 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.655 1.182 . . . . 0.0 112.515 176.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 1.74 77.67 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.815 1.198 . . . . 0.0 113.945 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -112.22 142.8 44.26 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 119.381 1.59 . . . . 0.0 110.622 -177.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.9 m -75.12 141.07 43.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 171.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.68 134.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.18 147.3 15.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.193 -1.781 . . . . 0.0 106.193 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 32.5 p90 -156.68 158.57 37.21 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.969 0.414 . . . . 0.0 111.677 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -147.3 175.22 10.94 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.125 0.97 . . . . 0.0 108.383 169.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 p -145.15 149.06 34.31 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.0 m -147.69 147.42 29.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.326 1.05 . . . . 0.0 109.274 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 mp 49.53 -87.65 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 126.937 2.095 . . . . 0.0 112.109 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -145.26 26.0 1.35 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.849 2.06 . . . . 0.0 109.277 -176.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.557 HD11 ' CG2' ' A' ' 18' ' ' ILE . 62.3 tp -131.23 147.43 52.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.388 1.875 . . . . 0.0 109.347 -169.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -126.41 145.18 50.57 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.3 139.81 49.65 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.454 1.502 . . . . 0.0 107.422 -172.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -146.24 147.86 31.87 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.824 0.85 . . . . 0.0 111.029 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 93.5 t -135.68 127.82 46.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 169.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mm -114.63 135.83 53.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -171.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.19 173.64 32.01 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.84 1.244 . . . . 0.0 112.019 -172.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -68.96 167.92 14.8 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.13 -1.535 . . . . 0.0 111.139 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.0 m -61.14 -46.97 88.39 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 170.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 10.3 t80 50.23 -167.11 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.048 2.139 . . . . 0.0 112.084 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -83.83 -14.91 50.11 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.589 -0.694 . . . . 0.0 111.405 171.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -161.19 163.13 31.37 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 124.89 1.276 . . . . 0.0 110.398 -172.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.09 -6.39 10.91 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.858 2.463 . . . . 0.0 110.452 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.17 -32.76 72.5 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 124.947 1.299 . . . . 0.0 110.571 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -64.06 -33.33 75.5 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.847 0.749 . . . . 0.0 111.601 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.4 mt -72.64 -44.24 62.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.6 mmt -54.33 -42.01 69.71 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.374 172.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -48.49 77.43 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.542 0.737 . . . . 0.0 110.236 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.93 -44.67 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.018 0.527 . . . . 0.0 110.277 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 47.3 tp -60.39 -51.84 67.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 118.618 0.645 . . . . 0.0 110.035 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -71.55 -31.83 67.45 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 118.584 -0.722 . . . . 0.0 110.989 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.76 -49.63 76.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.082 0.855 . . . . 0.0 109.659 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.72 -46.12 89.57 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.739 0.699 . . . . 0.0 110.709 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.74 -43.57 98.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.013 0.525 . . . . 0.0 111.346 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.73 -36.61 67.8 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 121.432 -0.792 . . . . 0.0 110.886 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.7 m -63.62 -44.15 94.77 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.765 0.711 . . . . 0.0 110.927 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.5 mt -52.26 -53.62 41.56 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.0 m -55.84 -40.42 72.83 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.412 0.445 . . . . 0.0 111.565 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -67.64 -43.75 79.58 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.999 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 12.5 ptt? -83.37 -29.05 28.52 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.59 1.086 . . . . 0.0 112.312 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.409 HD21 ' HB1' ' A' ' 113' ' ' ALA . 17.3 tp -88.79 -33.48 17.42 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.2 0.6 . . . . 0.0 112.24 -169.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 49.96 33.09 6.24 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.936 1.694 . . . . 0.0 114.132 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -153.1 -174.93 5.11 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.909 1.684 . . . . 0.0 106.908 169.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -48.19 125.77 9.87 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 m -78.01 45.13 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.616 1.166 . . . . 0.0 109.322 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -80.4 163.85 23.53 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.751 0.82 . . . . 0.0 109.994 176.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -59.11 -36.52 75.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -169.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.0 tpp85 -65.4 -42.02 93.03 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.013 0.824 . . . . 0.0 110.138 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.409 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -67.58 -33.41 74.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.478 0.581 . . . . 0.0 110.787 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.5 -44.59 86.53 Favored 'General case' 0 N--CA 1.461 0.094 0 O-C-N 121.404 -0.81 . . . . 0.0 110.905 171.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.79 -38.38 72.43 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.435 0.694 . . . . 0.0 110.862 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.29 -21.99 65.66 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.24 27.27 5.37 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.466 1.03 . . . . 0.0 112.977 -175.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -40.88 -48.47 3.12 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 125.666 1.586 . . . . 0.0 112.922 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.7 -39.61 94.55 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.985 0.811 . . . . 0.0 111.304 -177.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.13 -43.56 92.99 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -58.22 -51.06 71.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.322 1.049 . . . . 0.0 110.298 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -56.29 -46.03 79.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.332 0.653 . . . . 0.0 109.961 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.85 -40.41 91.68 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-O 118.885 -0.579 . . . . 0.0 111.372 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.76 -46.45 90.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.93 0.786 . . . . 0.0 109.694 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.6 -46.47 86.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.302 0.501 . . . . 0.0 109.904 175.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.46 -21.83 66.53 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 112.936 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -92.01 -28.72 17.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.895 0.878 . . . . 0.0 110.656 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.1 mt -80.06 -37.46 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 118.967 0.803 . . . . 0.0 109.525 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 20.6 t -140.14 143.67 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.308 1.043 . . . . 0.0 108.923 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -145.69 134.55 22.45 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.584 1.154 . . . . 0.0 107.982 169.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.82 29.46 54.89 Favored Glycine 0 CA--C 1.533 1.156 0 CA-C-O 119.537 -0.591 . . . . 0.0 112.965 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.33 14.38 79.3 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 117.98 0.89 . . . . 0.0 113.949 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 26.6 t -120.04 135.54 60.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 24.1 pt -60.96 157.38 2.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-O 121.141 0.496 . . . . 0.0 110.411 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.5 mt -118.18 -48.48 2.53 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 124.272 1.029 . . . . 0.0 108.765 173.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -157.14 156.54 32.86 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.153 1.381 . . . . 0.0 107.563 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.4 p -140.44 17.26 2.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.986 0.914 . . . . 0.0 111.801 -174.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.66 114.96 63.09 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 169.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.38 -32.84 31.52 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.968 1.779 . . . . 0.0 113.025 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.15 -48.84 74.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.696 0.68 . . . . 0.0 109.183 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -66.22 -40.93 90.65 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.347 -0.846 . . . . 0.0 109.948 -175.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -56.75 -57.07 10.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 123.866 0.866 . . . . 0.0 109.509 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.23 -39.63 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.406 0.548 . . . . 0.0 110.466 -172.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -63.04 -44.05 96.97 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.637 0.653 . . . . 0.0 110.311 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -61.09 -46.24 91.45 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.672 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.68 -27.23 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 119.606 1.094 . . . . 0.0 111.881 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.53 -38.83 74.28 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.858 0.753 . . . . 0.0 111.281 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 49.1 mt -71.01 -38.54 72.63 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.827 0.851 . . . . 0.0 110.944 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.246 176.43 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.9 p -68.85 -36.01 77.62 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -135.52 142.8 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 169.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -98.76 -25.82 14.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 117.636 -1.174 . . . . 0.0 109.978 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.19 166.49 29.59 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.672 1.123 . . . . 0.0 112.059 174.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.95 133.06 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 104.654 -2.35 . . . . 0.0 104.654 172.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.6 mt -135.09 149.96 50.15 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.8 mt -138.91 124.22 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.532 -2.395 . . . . 0.0 104.532 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.9 mt -121.47 147.95 45.08 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -173.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.23 168.15 12.88 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.552 0.692 . . . . 0.0 109.727 169.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -55.11 -20.49 10.13 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.0 0.83 30.38 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.62 1.1 . . . . 0.0 111.494 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.06 17.44 43.56 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.953 1.263 . . . . 0.0 112.771 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.89 137.93 39.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.305 1.552 . . . . 0.0 109.878 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -60.33 120.62 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 175.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.2 mt -97.67 -44.53 6.73 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 163.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -145.23 151.3 38.18 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.123 173.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.51 144.69 15.6 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 169.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -147.51 148.97 31.76 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.77 1.228 . . . . 0.0 107.856 171.877 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -136.88 148.1 46.87 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.779 1.631 . . . . 0.0 106.925 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -133.89 2.55 3.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.973 0.909 . . . . 0.0 111.568 -174.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -132.9 159.2 40.59 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.011 0.925 . . . . 0.0 108.991 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.87 5.57 3.16 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.274 2.23 . . . . 0.0 112.51 -174.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -61.62 -48.16 82.15 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.938 1.295 . . . . 0.0 110.58 177.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -143.9 73.69 16.6 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.533 1.133 . . . . 0.0 108.542 -177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.41 -0.69 6.02 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.654 2.236 . . . . 0.0 113.521 -171.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 m -135.04 139.78 45.08 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.061 0.944 . . . . 0.0 109.459 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -43.58 -53.04 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.607 1.963 . . . . 0.0 113.043 -169.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -62.51 -43.54 98.55 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.387 0.539 . . . . 0.0 111.115 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -68.93 -35.66 77.05 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -63.78 -50.97 66.91 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.367 0.667 . . . . 0.0 110.558 176.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.62 -37.64 73.63 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.398 -0.814 . . . . 0.0 110.877 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.21 -45.56 80.34 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -61.99 -37.95 86.76 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.101 0.56 . . . . 0.0 110.897 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.99 -42.17 97.29 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.751 1.62 . . . . 0.0 111.181 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -66.01 -42.26 89.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.472 -0.768 . . . . 0.0 109.919 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.55 -46.77 77.07 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.068 0.547 . . . . 0.0 110.849 173.213 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.9 mm -56.5 -54.95 22.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 C-N-CA 124.673 1.189 . . . . 0.0 108.301 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -60.14 -48.8 80.22 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.188 0.449 . . . . 0.0 110.842 -177.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -58.91 -39.76 82.49 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.549 1.14 . . . . 0.0 112.126 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -76.92 -47.49 20.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.135 0.574 . . . . 0.0 109.956 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.9 p -70.53 -26.81 63.74 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.454 -0.779 . . . . 0.0 112.403 -169.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -73.87 5.35 4.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.077 1.308 . . . . 0.0 112.428 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.08 14.09 9.79 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.309 1.844 . . . . 0.0 110.723 175.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.6 m -120.69 162.93 18.85 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.379 1.072 . . . . 0.0 109.318 -171.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -88.59 23.11 2.36 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.371 1.468 . . . . 0.0 112.992 -169.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.4 m 68.64 179.79 0.23 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 0.0 113.848 175.546 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.31 10.5 pt-20 56.94 -50.95 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 131.275 3.83 . . . . 0.0 116.13 -175.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.0 tt -151.54 155.29 7.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 120.377 1.444 . . . . 0.0 110.062 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.28 164.83 35.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.405 1.882 . . . . 0.0 109.23 -177.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.09 106.92 8.94 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 102.442 -3.17 . . . . 0.0 102.442 170.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mp -81.01 -64.51 1.17 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -168.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -139.8 7.15 2.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.592 1.557 . . . . 0.0 110.844 -172.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 144.84 -38.82 1.25 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 126.04 1.781 . . . . 0.0 109.383 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -80.01 139.44 36.97 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.137 0.975 . . . . 0.0 110.463 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 62.1 m -85.22 141.19 30.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.931 1.292 . . . . 0.0 107.556 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 93.7 t -138.19 131.3 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 106.338 -1.726 . . . . 0.0 106.338 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.6 m -107.91 145.29 15.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 169.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -156.86 159.19 37.95 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.93 0.395 . . . . 0.0 111.721 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -150.4 171.02 17.68 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.369 1.067 . . . . 0.0 108.562 170.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -143.71 140.89 30.24 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 m -146.77 142.07 27.37 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.541 0.737 . . . . 0.0 109.581 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 53.79 -85.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 127.176 2.191 . . . . 0.0 112.328 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -146.6 29.57 1.02 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.269 1.827 . . . . 0.0 108.911 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.459 HD21 HD22 ' A' ' 114' ' ' LEU . 50.0 tp -137.43 147.24 45.23 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.257 1.823 . . . . 0.0 109.446 -169.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -129.55 139.26 51.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -127.19 140.48 52.21 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.624 1.57 . . . . 0.0 107.938 -172.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -146.31 149.17 33.31 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.161 0.984 . . . . 0.0 111.396 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 86.0 t -140.6 140.76 33.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -130.82 134.99 61.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 -171.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.17 172.1 37.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-O 121.942 0.745 . . . . 0.0 113.065 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.4 m -63.08 129.27 39.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.207 1.403 . . . . 0.0 109.999 -173.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -77.01 33.45 0.15 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.204 1.802 . . . . 0.0 113.48 -172.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.08 169.57 8.25 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.21 1.004 . . . . 0.0 109.166 169.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.43 26.62 0.05 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.115 1.766 . . . . 0.0 113.484 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -138.09 46.78 2.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 125.785 1.634 . . . . 0.0 109.124 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -55.84 -14.97 2.7 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.439 -0.788 . . . . 0.0 111.603 169.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -51.12 -35.63 36.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.587 1.955 . . . . 0.0 111.213 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.1 ptt? -71.5 -32.77 68.6 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.566 1.076 . . . . 0.0 111.614 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.43 -48.2 73.56 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.21 -41.67 79.87 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 122.485 0.314 . . . . 0.0 110.341 178.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.26 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.737 0.815 . . . . 0.0 110.319 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.3 t -61.99 -44.38 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.077 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.91 -49.62 76.74 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.724 0.693 . . . . 0.0 110.493 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -63.34 -41.61 98.88 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 119.559 -0.258 . . . . 0.0 110.482 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.2 t -60.92 -49.98 75.26 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.193 0.597 . . . . 0.0 109.621 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.14 -45.66 90.87 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -60.69 -47.92 84.09 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.58 -36.52 78.84 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.75 -0.594 . . . . 0.0 111.409 -177.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 61.2 m -59.04 -48.2 82.46 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.748 0.819 . . . . 0.0 110.631 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 36.2 mt -53.82 -50.71 65.57 Favored 'General case' 0 C--N 1.342 0.264 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 174.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.6 m -55.77 -37.91 69.18 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.677 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -70.81 -55.71 7.94 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.169 1.349 . . . . 0.0 110.141 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -74.25 -29.85 61.87 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.821 -170.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.415 HD21 ' HB1' ' A' ' 113' ' ' ALA . 16.2 tp -88.71 -34.72 17.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.107 0.563 . . . . 0.0 111.388 -174.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.289 0.0 OUTLIER 41.04 48.82 2.96 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.887 1.675 . . . . 0.0 112.684 -173.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -136.83 179.63 6.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.043 2.137 . . . . 0.0 106.402 169.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -70.53 14.67 0.12 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.278 25.3 m 44.49 40.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 127.122 2.169 . . . . 0.0 112.142 -173.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.15 165.72 24.51 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.391 0.677 . . . . 0.0 111.093 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -46.37 -51.61 14.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.429 1.892 . . . . 0.0 112.904 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -67.29 -41.38 85.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.139 0.427 . . . . 0.0 110.275 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.415 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -64.45 -34.96 79.42 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.646 -0.659 . . . . 0.0 110.523 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.459 HD22 HD21 ' A' ' 75' ' ' LEU . 3.5 mp -64.87 -46.97 79.56 Favored 'General case' 0 CA--C 1.521 -0.172 0 O-C-N 121.269 -0.894 . . . . 0.0 110.895 172.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.7 tp -55.2 -37.16 66.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.404 0.682 . . . . 0.0 111.081 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -70.37 -18.81 63.06 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.43 25.14 4.46 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.649 1.113 . . . . 0.0 113.014 -174.141 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -41.21 -47.35 3.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.467 1.507 . . . . 0.0 112.419 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.92 -39.43 94.16 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.037 0.835 . . . . 0.0 111.903 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.06 -43.75 98.34 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.2 tp -57.95 -49.37 77.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.977 0.911 . . . . 0.0 110.684 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -55.83 -47.63 76.89 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.483 0.583 . . . . 0.0 109.61 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.2 mt -67.57 -35.91 79.92 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.291 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.8 90.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.732 0.696 . . . . 0.0 109.85 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.6 t -57.44 -43.84 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 118.801 0.728 . . . . 0.0 109.648 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.07 3.82 3.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.139 0.976 . . . . 0.0 113.611 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -120.34 -27.13 5.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.605 1.562 . . . . 0.0 110.988 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.97 -39.7 77.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.255 0.934 . . . . 0.0 108.851 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.23 157.93 43.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.837 0.827 . . . . 0.0 110.738 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -145.62 130.1 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.951 1.7 . . . . 0.0 106.744 169.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.65 32.42 53.95 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.377 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.59 19.82 76.72 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.377 1.088 . . . . 0.0 113.662 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 72.4 t -124.64 139.56 50.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 174.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.18 135.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.346 0.593 . . . . 0.0 110.092 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -116.82 -42.24 2.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.714 1.606 . . . . 0.0 108.354 -173.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -147.86 152.1 37.05 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -131.5 -12.68 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.693 1.197 . . . . 0.0 111.428 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.76 117.04 62.07 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.337 0.971 . . . . 0.0 108.638 169.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.36 -31.68 27.66 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.24 1.96 . . . . 0.0 112.152 -172.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -44.38 85.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.614 -0.679 . . . . 0.0 109.319 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.89 -38.79 92.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.635 0.652 . . . . 0.0 110.544 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.6 t -56.71 -52.31 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 118.86 0.754 . . . . 0.0 109.366 173.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.9 t -63.14 -38.53 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.966 0.803 . . . . 0.0 110.499 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.2 -39.75 93.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.153 0.888 . . . . 0.0 110.822 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -64.34 -46.01 85.33 Favored 'General case' 0 CA--C 1.526 0.034 0 CA-C-N 118.723 0.692 . . . . 0.0 110.543 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.96 -40.69 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 118.904 0.774 . . . . 0.0 109.618 177.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.04 -33.74 72.35 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.569 0.748 . . . . 0.0 112.1 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 30.9 mt -72.64 -32.7 66.1 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.062 0.945 . . . . 0.0 111.936 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 . . . . . 0 C--O 1.25 1.088 0 CA-C-N 118.336 0.517 . . . . 0.0 109.898 178.08 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 . . . . . 0 C--O 1.235 0.339 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.1 p -74.7 -34.81 62.7 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.9 t -132.03 139.98 49.01 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -106.85 -30.11 9.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.705 176.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.19 167.48 26.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.83 1.196 . . . . 0.0 111.847 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.5 mt -139.45 135.22 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 172.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.15 154.6 49.17 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.483 HG22 HD11 ' A' ' 75' ' ' LEU . 39.7 mt -139.61 120.42 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.669 -2.715 . . . . 0.0 103.669 169.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.12 143.57 48.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.613 0.765 . . . . 0.0 109.459 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -67.61 168.74 10.56 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 168.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -14.71 61.96 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.1 0.96 . . . . 0.0 112.244 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -74.63 -9.52 58.65 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.139 0.975 . . . . 0.0 112.207 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.24 52.89 9.8 Favored Glycine 0 C--N 1.341 0.849 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -172.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -136.92 131.44 33.07 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.633 1.173 . . . . 0.0 109.306 -173.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -59.66 107.23 0.57 Allowed 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.868 0.867 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 mt -73.83 -37.34 64.88 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 155.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -143.2 148.92 37.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.615 1.566 . . . . 0.0 107.851 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.89 141.89 10.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.4 OUTLIER -149.35 148.28 29.32 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.607 1.563 . . . . 0.0 107.714 176.903 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.43 152.24 46.9 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.711 1.604 . . . . 0.0 108.056 -173.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -136.12 -4.21 2.17 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.214 1.005 . . . . 0.0 112.581 -174.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -134.2 158.53 43.47 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.12 0.873 . . . . 0.0 110.037 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.4 2.05 6.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.144 2.177 . . . . 0.0 112.747 -172.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 p -59.71 -48.44 81.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.65 1.18 . . . . 0.0 110.431 174.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -145.16 75.61 13.85 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.5 1.12 . . . . 0.0 108.704 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -90.36 -0.99 5.38 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.714 2.276 . . . . 0.0 113.695 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -135.51 140.13 44.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 119.14 0.882 . . . . 0.0 109.943 -169.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.3 t -45.41 -50.4 3.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.532 1.933 . . . . 0.0 113.062 -169.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -57.9 -48.72 79.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.545 0.611 . . . . 0.0 110.927 -176.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.91 -35.13 72.15 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -63.29 -51.2 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.592 0.757 . . . . 0.0 110.924 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -62.01 -32.61 73.11 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.026 -1.046 . . . . 0.0 111.246 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.88 71.77 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.3 -38.96 88.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.998 0.919 . . . . 0.0 111.513 178.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -61.0 -48.96 79.4 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.046 1.738 . . . . 0.0 110.59 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -68.76 -35.43 77.07 Favored 'General case' 0 N--CA 1.463 0.175 0 O-C-N 121.75 -0.594 . . . . 0.0 110.903 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -47.83 76.9 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.536 0.734 . . . . 0.0 110.553 169.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.4 mt -61.56 -47.34 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.278 0.631 . . . . 0.0 109.703 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -60.42 -47.09 87.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.631 0.65 . . . . 0.0 109.961 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -54.58 -48.02 72.61 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.059 0.943 . . . . 0.0 111.524 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.8 mmmt -69.97 -49.36 52.47 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.306 0.642 . . . . 0.0 110.016 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 39.2 p -70.3 -27.46 64.41 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.638 -0.664 . . . . 0.0 111.818 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -62.14 -17.96 59.46 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.895 0.77 . . . . 0.0 111.943 170.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -117.59 25.04 10.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.313 1.845 . . . . 0.0 110.036 -175.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.8 m -132.55 158.22 42.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.841 1.656 . . . . 0.0 107.608 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.82 -41.8 98.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.1 m 141.89 -174.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 1 C-N-CA 132.531 4.332 . . . . 0.0 108.633 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.335 10.1 pt-20 61.08 -47.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 131.366 3.866 . . . . 0.0 116.859 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.61 152.54 10.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 120.198 1.363 . . . . 0.0 109.871 -175.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.79 165.18 31.33 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.404 1.882 . . . . 0.0 108.72 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -134.42 104.42 6.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 103.132 -2.914 . . . . 0.0 103.132 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -67.48 -63.09 1.13 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.358 -169.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -149.34 1.75 0.54 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.394 2.278 . . . . 0.0 110.308 -174.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.39 -35.95 1.21 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.03 1.776 . . . . 0.0 109.962 -171.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.0 mt -72.07 125.35 27.05 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 170.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 m -82.04 141.57 33.08 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.6 t -131.23 137.18 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.96 135.87 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -157.85 171.17 20.78 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.593 0.711 . . . . 0.0 112.072 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.9 tttp -153.94 157.08 38.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.026 1.73 . . . . 0.0 106.788 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -137.71 133.07 33.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -152.98 144.03 23.03 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.152 0.581 . . . . 0.0 110.401 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 mt 65.0 -84.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.403 1.881 . . . . 0.0 109.475 173.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -150.82 21.07 0.79 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.818 1.647 . . . . 0.0 109.52 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.483 HD11 HG22 ' A' ' 18' ' ' ILE . 21.9 tp -125.77 147.25 49.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 126.787 2.035 . . . . 0.0 110.144 -168.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -129.38 134.64 47.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -123.75 138.62 54.48 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.148 1.379 . . . . 0.0 107.501 -169.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -144.8 150.3 36.93 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.643 1.11 . . . . 0.0 112.099 -170.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.0 t -137.26 140.7 41.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 127.441 2.296 . . . . 0.0 104.953 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -131.14 135.87 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 -177.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.47 175.74 30.97 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-O 122.802 1.223 . . . . 0.0 112.502 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.9 m -61.21 154.17 24.16 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 112.599 -1.8 . . . . 0.0 110.639 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.4 m -57.01 -39.11 74.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.327 0.651 . . . . 0.0 109.881 171.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 5.9 t80 48.98 -143.59 0.48 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.689 1.996 . . . . 0.0 110.683 169.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.47 6.73 6.31 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.157 1.383 . . . . 0.0 111.625 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -159.19 163.19 36.21 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.489 1.516 . . . . 0.0 109.049 174.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -120.89 -6.87 9.56 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.436 2.294 . . . . 0.0 110.472 175.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.2 mt -57.17 -35.33 69.43 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 125.832 1.653 . . . . 0.0 110.655 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -65.06 -34.16 77.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.582 0.628 . . . . 0.0 111.912 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -73.51 -40.88 63.7 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.8 -45.57 70.8 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.982 . . . . 0.0 110.373 169.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.41 75.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.257 1.023 . . . . 0.0 110.387 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.5 t -61.34 -44.56 98.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 C-N-CA 123.3 0.64 . . . . 0.0 110.006 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.4 tp -60.15 -48.99 79.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.2 0.455 . . . . 0.0 110.274 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -61.37 -44.82 96.51 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 119.47 -0.3 . . . . 0.0 110.4 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 94.6 m -62.5 -45.53 92.57 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 118.885 -0.579 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.6 tp -65.95 -46.19 79.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.195 0.907 . . . . 0.0 110.819 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -64.16 -41.99 96.92 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 117.981 0.355 . . . . 0.0 110.799 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.76 -39.55 84.14 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.571 -0.705 . . . . 0.0 110.801 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.1 m -59.8 -48.05 83.25 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.323 0.649 . . . . 0.0 110.734 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -52.88 -48.86 66.83 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -60.24 -27.13 66.96 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.355 -0.831 . . . . 0.0 113.028 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.5 mm-40 -81.9 -53.33 6.25 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 120.12 1.327 . . . . 0.0 110.771 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -78.75 -33.79 46.27 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -168.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.56 -43.87 68.58 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.304 0.956 . . . . 0.0 109.104 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? 49.61 51.53 16.28 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.817 1.247 . . . . 0.0 110.048 -169.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -137.49 -171.37 2.96 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.762 2.425 . . . . 0.0 106.875 176.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -77.38 5.84 8.0 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.273 0.629 . . . . 0.0 112.113 175.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.324 4.8 m 49.2 40.34 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 126.91 2.084 . . . . 0.0 112.204 -174.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.27 168.83 18.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.128 0.971 . . . . 0.0 110.205 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -49.16 -48.23 45.1 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.605 1.162 . . . . 0.0 112.591 -176.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -66.4 -39.95 89.33 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 118.644 -0.694 . . . . 0.0 110.341 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.34 -36.88 85.17 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.201 0.91 . . . . 0.0 110.487 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.99 -47.06 78.89 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.769 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.3 tp -56.67 -38.06 71.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.69 0.677 . . . . 0.0 111.331 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.62 -19.08 64.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.03 0.932 . . . . 0.0 112.887 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -131.75 24.77 4.69 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.105 0.962 . . . . 0.0 111.561 -169.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -47.88 -47.66 31.7 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.917 1.287 . . . . 0.0 111.472 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -66.93 -36.34 82.02 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.241 0.473 . . . . 0.0 111.416 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.44 96.51 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.1 -49.07 79.09 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.685 1.194 . . . . 0.0 111.096 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -54.11 -48.42 70.76 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.983 0.811 . . . . 0.0 110.362 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 71.9 mt -68.43 -34.85 76.73 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.097 -0.478 . . . . 0.0 111.526 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.9 -44.94 83.79 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.925 0.784 . . . . 0.0 109.867 175.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.6 t -56.61 -45.29 82.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.8 -5.92 10.37 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.867 1.267 . . . . 0.0 113.686 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -112.3 -18.39 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 111.774 174.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 80.9 mt -81.4 -41.64 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.487 1.04 . . . . 0.0 108.467 172.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.9 p -145.0 148.11 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.267 1.027 . . . . 0.0 109.003 -169.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -146.89 136.44 22.93 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.8 29.58 50.41 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.928 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.68 14.86 81.69 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 118.171 0.986 . . . . 0.0 113.627 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.72 125.99 73.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.1 pt -57.93 145.72 8.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.3 pp -133.99 -13.33 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.022 0.929 . . . . 0.0 111.875 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -149.14 157.41 43.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.136 0.88 . . . . 0.0 108.964 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.7 p -143.93 31.06 1.28 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.809 1.643 . . . . 0.0 109.96 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -134.63 114.04 12.09 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 125.08 1.352 . . . . 0.0 107.897 178.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.82 -31.49 10.22 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.308 2.005 . . . . 0.0 112.16 -170.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -66.64 -45.38 79.21 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -71.98 -30.55 65.37 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.214 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.6 t -57.07 -54.62 27.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.612 1.096 . . . . 0.0 108.451 169.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.18 -36.18 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 119.159 0.89 . . . . 0.0 111.275 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -55.77 -49.82 72.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.134 0.879 . . . . 0.0 109.989 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -63.01 -40.66 98.44 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.407 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 69.3 t -59.37 -43.54 90.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.778 1.172 . . . . 0.0 109.935 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.7 75.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.307 0.643 . . . . 0.0 111.674 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.23 -37.39 80.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 125.966 1.706 . . . . 0.0 111.622 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 . . . . . 0 C--O 1.249 1.047 0 C-N-CA 123.999 0.919 . . . . 0.0 109.817 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 . . . . . 0 C--O 1.236 0.366 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 36.1 p -72.35 -31.65 65.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 173.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 m -136.44 139.81 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 123.64 0.776 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -91.94 -36.01 13.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.183 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.27 167.25 24.24 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.239 0.927 . . . . 0.0 112.541 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.7 mt -135.32 135.7 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 104.789 -2.301 . . . . 0.0 104.789 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 mt -133.92 151.93 51.67 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.5 mt -139.72 120.21 14.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 169.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 mt -123.76 144.5 49.65 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -172.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 168.41 9.61 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.401 170.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -71.68 10.46 0.66 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.665 1.186 . . . . 0.0 113.881 -174.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.99 5.17 5.94 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.64 1.576 . . . . 0.0 110.621 169.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 6.02 58.25 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 125.286 1.422 . . . . 0.0 113.203 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -69.83 132.42 46.01 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.426 1.613 . . . . 0.0 109.865 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -60.21 123.75 18.18 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.3 mt -100.11 -41.27 7.2 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 162.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -147.86 152.12 37.08 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.431 0.692 . . . . 0.0 109.6 172.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.08 146.63 18.99 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 169.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -146.39 145.19 30.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 172.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -134.67 148.65 50.39 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 125.621 1.569 . . . . 0.0 106.855 -177.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -130.41 7.14 4.9 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.267 1.027 . . . . 0.0 110.684 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -133.66 147.38 51.42 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.081 0.952 . . . . 0.0 110.674 -170.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.61 -7.51 33.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.163 1.785 . . . . 0.0 114.483 -169.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.9 p -67.04 -35.29 79.57 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.646 1.112 . . . . 0.0 112.618 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -141.36 63.51 17.7 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 119.323 0.965 . . . . 0.0 111.231 -174.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -86.69 -1.39 8.21 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.98 2.454 . . . . 0.0 113.314 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.2 m -134.73 140.49 45.99 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.086 0.955 . . . . 0.0 109.511 -169.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.2 t -44.52 -52.63 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 126.338 1.855 . . . . 0.0 112.955 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.87 -43.24 98.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.683 0.674 . . . . 0.0 111.193 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.57 -33.97 64.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.4 -50.01 75.28 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-O 118.691 -0.671 . . . . 0.0 109.726 172.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -57.52 -37.2 72.64 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.176 0.898 . . . . 0.0 111.405 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.25 -50.13 72.96 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.313 0.645 . . . . 0.0 109.508 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.4 -37.48 87.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.847 0.459 . . . . 0.0 111.578 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.48 -45.74 91.64 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.131 1.772 . . . . 0.0 110.537 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.87 -42.94 97.39 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.903 -0.498 . . . . 0.0 109.993 175.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.0 -49.96 70.2 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.214 0.606 . . . . 0.0 110.888 173.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -58.05 -51.77 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.061 0 C-N-CA 123.974 0.91 . . . . 0.0 108.766 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -60.64 -47.91 84.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.371 0.532 . . . . 0.0 110.702 -174.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -56.65 -50.6 71.57 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 122.889 0.476 . . . . 0.0 110.855 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -64.83 -46.75 80.65 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.3 p -71.03 -32.62 69.42 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.669 -0.644 . . . . 0.0 111.822 -174.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -62.72 -12.73 25.71 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.368 -0.833 . . . . 0.0 111.701 170.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -122.34 25.02 9.12 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.063 1.745 . . . . 0.0 109.754 -175.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 99.2 m -133.06 161.64 33.84 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.834 1.653 . . . . 0.0 108.505 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -87.47 25.34 1.45 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.441 1.496 . . . . 0.0 113.426 -169.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.478 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 7.2 m 69.05 178.92 0.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.79 1.636 . . . . 0.0 113.728 176.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.6 pt-20 55.96 -46.56 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 131.107 3.763 . . . . 0.0 116.706 -174.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.8 tt -149.78 156.81 6.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 120.278 1.399 . . . . 0.0 109.62 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.87 158.29 43.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.479 1.912 . . . . 0.0 108.392 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -121.89 99.24 6.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 101.754 -3.424 . . . . 0.0 101.754 169.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.41 -62.3 1.61 Allowed 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 123.64 0.776 . . . . 0.0 112.217 -168.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -149.44 4.96 0.61 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.582 1.953 . . . . 0.0 110.783 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 142.75 -35.39 1.71 Allowed Glycine 0 CA--C 1.528 0.852 0 C-N-CA 126.353 1.93 . . . . 0.0 108.817 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.35 133.51 47.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.322 1.049 . . . . 0.0 108.418 169.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.3 m -90.2 144.11 26.16 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.6 t -136.54 137.89 47.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.3 m -119.92 146.18 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.478 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 25.7 p90 -157.74 160.27 37.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.091 0.472 . . . . 0.0 110.848 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -148.16 174.59 11.81 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.137 0.975 . . . . 0.0 108.63 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.7 p -140.57 145.46 36.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 171.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -146.79 142.29 27.58 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.69 0.796 . . . . 0.0 109.341 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.6 mp 53.03 -84.29 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.155 2.182 . . . . 0.0 111.454 -174.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -149.85 30.76 0.72 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.415 1.886 . . . . 0.0 109.06 -176.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.6 tp -137.83 148.18 45.22 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.203 1.401 . . . . 0.0 109.774 -169.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -124.9 146.55 49.27 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.926 0.891 . . . . 0.0 108.95 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -135.69 142.97 45.17 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.41 1.484 . . . . 0.0 107.96 -171.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -147.53 151.07 35.7 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.023 0.929 . . . . 0.0 111.258 -170.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -139.8 141.16 34.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 169.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.91 135.49 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 -173.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -167.71 -176.75 38.61 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-O 121.984 0.769 . . . . 0.0 113.532 -178.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.9 m -62.41 161.19 12.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.703 1.601 . . . . 0.0 111.605 -176.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.8 p -126.37 13.67 7.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.007 1.323 . . . . 0.0 111.966 -170.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 2.1 p90 -54.79 -50.4 68.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.772 1.629 . . . . 0.0 113.416 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -147.33 -23.3 0.39 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -172.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.64 155.35 38.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.097 0.862 . . . . 0.0 110.395 -170.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.12 -8.33 7.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.921 2.088 . . . . 0.0 110.68 175.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.415 HD12 ' H ' ' A' ' 88' ' ' LEU . 4.4 mp -58.2 -33.93 69.83 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.975 1.31 . . . . 0.0 110.935 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -65.66 -33.84 76.82 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.906 0.775 . . . . 0.0 111.459 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 36.9 mt -70.42 -46.49 63.83 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.1 mmt -55.54 -40.44 71.87 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.305 173.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.76 71.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.847 0.859 . . . . 0.0 110.04 -178.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.61 -45.02 99.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 118.33 0.513 . . . . 0.0 110.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.97 -49.27 78.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.422 0.556 . . . . 0.0 110.312 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -63.52 -43.59 96.72 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.337 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 96.8 m -61.71 -45.32 94.46 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.32 -45.89 78.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.45 1.023 . . . . 0.0 110.861 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -62.41 -43.33 99.07 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.429 0.633 . . . . 0.0 110.997 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.22 -37.33 72.05 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.346 -0.846 . . . . 0.0 110.947 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -60.53 -48.54 81.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.512 0.597 . . . . 0.0 110.587 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.4 mt -50.72 -51.23 51.9 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 173.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -55.0 -42.61 72.72 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.872 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -69.42 -48.72 60.12 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 119.577 1.08 . . . . 0.0 111.777 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 11.6 ptt? -73.6 -28.72 61.97 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.459 1.027 . . . . 0.0 112.003 -174.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 21.1 tp -85.4 -35.02 21.59 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -171.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 52.26 28.88 6.01 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.307 1.443 . . . . 0.0 113.765 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -153.59 -178.25 6.89 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.235 1.814 . . . . 0.0 106.89 169.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -48.07 131.89 15.71 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.895 0.878 . . . . 0.0 109.195 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 29.9 m -79.99 38.95 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 124.733 1.213 . . . . 0.0 110.22 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -78.2 171.39 15.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.613 1.165 . . . . 0.0 111.772 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -44.88 -61.21 1.69 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.079 1.752 . . . . 0.0 112.667 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -61.93 -41.43 97.94 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.949 -0.469 . . . . 0.0 110.337 -179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.31 -31.54 67.55 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.822 -0.549 . . . . 0.0 112.098 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -77.76 -32.99 52.93 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.09 -1.006 . . . . 0.0 109.96 173.494 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.53 -33.88 71.95 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.736 0.698 . . . . 0.0 110.923 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -71.15 -17.83 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.27 -0.894 . . . . 0.0 113.265 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -129.98 28.44 5.06 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.453 1.024 . . . . 0.0 112.789 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.76 -48.14 2.17 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.921 1.688 . . . . 0.0 112.722 174.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.94 -37.9 89.17 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.111 0.869 . . . . 0.0 111.725 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.96 -43.51 95.84 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 176.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.25 -49.04 78.53 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.98 0.912 . . . . 0.0 110.879 173.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.08 -48.32 76.33 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.513 0.597 . . . . 0.0 109.396 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.75 -37.08 85.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.177 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.44 95.73 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.916 0.78 . . . . 0.0 110.593 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.8 t -60.38 -45.62 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 118.906 0.775 . . . . 0.0 109.09 174.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -73.49 18.2 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.064 1.346 . . . . 0.0 112.991 176.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -135.54 -25.67 1.29 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.665 1.586 . . . . 0.0 110.757 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.71 -29.09 8.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.356 1.062 . . . . 0.0 109.552 171.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.8 t -138.04 147.5 25.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 119.685 1.129 . . . . 0.0 108.638 -171.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -144.28 126.19 15.34 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 125.473 1.509 . . . . 0.0 107.366 169.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.9 32.29 59.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 119.431 -0.649 . . . . 0.0 113.657 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.76 12.52 84.43 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.264 1.032 . . . . 0.0 113.672 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.9 t -121.13 141.26 42.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 30.3 pt -55.17 140.26 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-O 121.959 0.885 . . . . 0.0 110.049 174.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -113.66 -44.22 3.22 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 126.621 1.968 . . . . 0.0 107.512 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -145.74 161.84 38.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.0 m -148.19 38.69 0.89 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.193 0.997 . . . . 0.0 110.679 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -132.95 117.44 14.94 Favored Pre-proline 0 C--O 1.235 0.335 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.65 -42.93 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.077 1.851 . . . . 0.0 113.01 -169.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.257 1.9 pp0? -69.38 -27.53 65.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.938 -1.101 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.58 -43.53 69.24 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 119.628 1.103 . . . . 0.0 109.741 175.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 11.7 t -52.46 -49.91 41.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 170.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.6 t -63.2 -39.28 84.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.697 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -57.57 -51.1 70.86 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 119.515 1.052 . . . . 0.0 109.273 175.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -62.56 -40.67 97.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.636 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.67 -43.3 96.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 120.071 1.305 . . . . 0.0 109.632 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.22 79.16 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.211 0.604 . . . . 0.0 111.512 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.31 -39.28 78.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.036 1.734 . . . . 0.0 111.974 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.139 1.376 . . . . 0.0 110.095 -176.178 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 . . . . . 0 C--O 1.235 0.334 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -63.98 -34.8 78.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.055 0.942 . . . . 0.0 110.186 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -157.13 160.6 2.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -174.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -123.06 -40.0 2.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.947 1.299 . . . . 0.0 110.088 -175.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.97 168.8 23.84 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.432 0.56 . . . . 0.0 111.179 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.4 mt -137.4 137.1 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 105.282 -2.118 . . . . 0.0 105.282 173.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -134.29 150.23 50.97 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.2 mt -137.19 120.09 20.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 169.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.7 mt -124.13 143.04 50.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -170.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.46 168.47 8.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.475 170.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -72.4 13.82 0.3 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.643 1.177 . . . . 0.0 113.794 -174.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -131.32 6.34 4.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.883 1.673 . . . . 0.0 110.327 169.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.87 5.96 59.55 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.397 1.475 . . . . 0.0 113.403 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -70.21 131.86 44.87 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 119.526 1.663 . . . . 0.0 109.918 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -60.64 118.79 7.01 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.51 -41.54 8.13 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 165.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -146.5 152.53 39.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.14 146.86 20.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 169.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -142.16 139.23 32.03 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 171.606 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -127.56 147.84 50.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 174.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -129.23 8.84 5.59 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.125 0.57 . . . . 0.0 110.571 -177.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -141.05 152.25 44.69 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.431 0.692 . . . . 0.0 111.81 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.68 -7.76 23.04 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.371 1.868 . . . . 0.0 113.962 -174.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 p -58.91 -42.73 90.33 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.149 -0.969 . . . . 0.0 112.157 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -145.16 72.26 14.6 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 119.079 0.854 . . . . 0.0 109.925 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -90.34 -1.17 5.39 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.811 2.341 . . . . 0.0 113.35 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.3 m -132.44 137.09 47.15 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.567 -169.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.4 t -46.87 -48.37 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.299 1.84 . . . . 0.0 112.683 -169.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -57.5 -48.0 80.41 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.417 0.553 . . . . 0.0 111.024 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -74.31 -33.35 63.17 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -61.34 -51.3 69.43 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.066 0.546 . . . . 0.0 110.714 174.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -61.49 -32.31 72.32 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.054 -1.029 . . . . 0.0 111.215 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -48.43 72.26 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -61.34 -38.43 86.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.406 0.683 . . . . 0.0 111.195 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.33 -44.94 93.48 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.41 1.484 . . . . 0.0 111.15 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -43.59 98.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.155 0.434 . . . . 0.0 109.84 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.29 -48.48 74.02 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.634 0.773 . . . . 0.0 110.946 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -59.27 -53.37 49.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -60.17 -44.85 94.71 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.648 0.379 . . . . 0.0 110.624 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -61.95 -47.61 84.11 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.278 0.631 . . . . 0.0 111.489 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -74.48 -48.66 25.95 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 122.787 0.435 . . . . 0.0 110.355 -170.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 p -59.18 -35.35 73.41 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.264 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -54.16 -26.76 29.65 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -77.91 -16.94 57.83 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 119.05 0.841 . . . . 0.0 112.778 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.7 p -78.33 173.24 12.53 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.364 0.984 . . . . 0.0 111.4 -174.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.22 -5.22 48.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.303 1.041 . . . . 0.0 112.125 169.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 m 77.77 143.51 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.547 2.739 . . . . 0.0 113.762 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 127.29 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 1 C-N-CA 133.338 4.655 . . . . 0.0 108.703 172.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.0 tt -154.42 157.3 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.698 1.199 . . . . 0.0 109.002 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.04 166.73 27.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.693 2.397 . . . . 0.0 107.98 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 tp -130.05 112.24 13.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 174.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -84.23 -165.52 1.18 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.04 1.336 . . . . 0.0 108.962 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.89 19.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.339 2.256 . . . . 0.0 114.369 -173.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.96 -3.0 0.47 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.559 1.552 . . . . 0.0 112.621 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.3 mt -126.32 131.98 51.72 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 118.353 1.076 . . . . 0.0 109.525 -170.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.0 m -75.68 141.61 42.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 84.5 t -137.97 117.94 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -98.2 146.23 8.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 169.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -155.66 162.72 40.54 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.989 0.359 . . . . 0.0 111.136 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -148.4 176.03 10.63 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.205 1.002 . . . . 0.0 108.636 170.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.6 p -141.26 148.6 40.09 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 m -144.7 141.87 29.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.0 mt 62.74 -78.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 126.879 2.072 . . . . 0.0 111.13 170.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -156.9 34.59 0.3 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.668 1.987 . . . . 0.0 108.931 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.5 tp -145.13 149.67 35.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.099 1.36 . . . . 0.0 109.784 -169.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -126.51 148.68 49.67 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.53 1.132 . . . . 0.0 109.231 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -137.34 140.55 41.55 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 125.378 1.471 . . . . 0.0 107.968 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -145.13 149.03 34.28 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 123.948 0.899 . . . . 0.0 110.501 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 96.5 t -136.32 136.54 48.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 169.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -127.44 137.77 56.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 -170.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -158.24 -177.39 31.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-O 121.742 0.635 . . . . 0.0 112.11 -176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 m -58.76 158.12 8.53 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.136 1.374 . . . . 0.0 112.188 -174.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 p -74.46 38.5 0.12 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.458 1.903 . . . . 0.0 111.058 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -69.05 167.93 14.94 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.978 1.311 . . . . 0.0 111.029 -171.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.69 -10.25 50.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.455 1.102 . . . . 0.0 113.375 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -148.01 171.19 16.22 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.903 1.281 . . . . 0.0 108.889 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.53 3.63 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.233 2.213 . . . . 0.0 110.76 -170.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.83 -31.68 72.78 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.472 1.109 . . . . 0.0 110.868 -173.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -33.44 75.82 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.871 0.759 . . . . 0.0 111.332 173.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.2 mt -71.19 -44.7 64.92 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.2 mmt -56.03 -41.0 74.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.282 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.39 -47.04 80.74 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.472 0.709 . . . . 0.0 110.3 -178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.1 t -62.01 -45.66 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-O 118.696 -0.668 . . . . 0.0 109.943 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 58.8 tp -61.21 -47.73 84.76 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.874 0.761 . . . . 0.0 110.331 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -64.56 -43.63 93.31 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.32 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 45.8 t -60.62 -50.61 72.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.268 0.627 . . . . 0.0 109.685 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.0 tp -61.97 -46.48 89.1 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.319 0.509 . . . . 0.0 110.992 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -64.67 -42.39 95.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.312 0.506 . . . . 0.0 111.046 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.73 -37.73 82.58 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 121.435 -0.791 . . . . 0.0 110.644 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.2 m -61.5 -46.73 88.77 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.664 0.785 . . . . 0.0 110.84 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.9 mt -54.72 -47.98 73.08 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.0 m -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.859 0.464 . . . . 0.0 111.879 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -73.12 -55.22 6.77 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.824 1.193 . . . . 0.0 109.69 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 67.0 mtm -66.03 -41.94 90.24 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.276 0.36 . . . . 0.0 111.751 -169.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.95 -35.86 77.26 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 118.041 0.382 . . . . 0.0 110.601 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.94 27.87 6.0 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.849 1.259 . . . . 0.0 112.455 -174.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -155.61 -175.34 5.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 126.739 2.016 . . . . 0.0 107.99 174.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.29 125.88 22.61 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.978 0.911 . . . . 0.0 108.789 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.3 m -77.95 46.73 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 125.371 1.468 . . . . 0.0 110.857 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.33 167.79 20.96 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.274 -0.891 . . . . 0.0 111.423 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -44.8 -54.17 6.64 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.104 1.762 . . . . 0.0 112.355 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -40.27 88.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.143 -0.348 . . . . 0.0 110.525 -176.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.5 -34.93 79.36 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.973 -0.455 . . . . 0.0 111.428 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.0 mp -67.87 -43.57 79.1 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 119.191 0.905 . . . . 0.0 110.46 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 69.7 tp -56.02 -37.26 68.95 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.28 0.491 . . . . 0.0 110.848 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -70.13 -18.81 63.24 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.279 1.032 . . . . 0.0 113.169 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -129.14 23.2 5.63 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.565 1.075 . . . . 0.0 111.442 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.65 -47.59 20.13 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.219 1.408 . . . . 0.0 111.832 -178.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -63.92 -39.73 94.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.941 0.791 . . . . 0.0 111.515 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.78 -43.6 95.97 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 tp -58.81 -50.44 73.95 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.287 1.035 . . . . 0.0 110.653 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -54.43 -49.03 70.94 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.481 0.712 . . . . 0.0 109.719 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.47 -33.87 76.01 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.601 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.94 80.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 118.859 0.754 . . . . 0.0 110.014 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 72.9 t -60.49 -41.04 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 118.658 0.663 . . . . 0.0 109.95 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.58 -24.83 67.96 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.402 0.681 . . . . 0.0 112.534 177.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -87.05 -34.73 19.08 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.576 -0.702 . . . . 0.0 110.683 177.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.86 -39.22 45.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.765 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 23.9 t -137.66 148.18 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 120.274 1.397 . . . . 0.0 111.851 -169.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -150.66 133.02 15.52 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.847 1.659 . . . . 0.0 108.033 169.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.66 24.99 54.84 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-O 119.487 -0.618 . . . . 0.0 114.632 173.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.07 18.33 69.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.379 1.09 . . . . 0.0 112.856 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.92 141.67 44.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.9 pt -70.55 154.96 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 119.684 -0.806 . . . . 0.0 109.859 176.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.6 mt -118.9 -19.28 8.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.029 1.331 . . . . 0.0 110.021 169.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -155.37 160.83 41.01 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 108.623 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -143.6 -5.98 0.81 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.558 1.143 . . . . 0.0 112.262 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.07 118.63 70.29 Favored Pre-proline 0 C--O 1.236 0.375 0 CA-C-N 119.735 1.152 . . . . 0.0 109.359 170.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -67.55 -30.94 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.902 1.735 . . . . 0.0 112.273 -174.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -64.64 -47.64 77.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -62.9 -38.69 91.94 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 118.392 0.542 . . . . 0.0 110.215 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.24 -58.49 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 30.1 m -67.0 -32.84 59.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.653 -173.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -61.13 -52.22 65.8 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.404 1.002 . . . . 0.0 109.987 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 80.0 mtt180 -61.52 -44.46 97.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 118.543 0.61 . . . . 0.0 110.091 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 15.2 t -58.45 -47.99 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.32 0.648 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.67 -29.92 56.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 122.681 0.392 . . . . 0.0 111.341 -171.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.27 -34.29 65.71 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.37 0.668 . . . . 0.0 111.108 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.1 mtm-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-N 118.375 0.534 . . . . 0.0 110.167 174.912 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 . . . . . 0 C--O 1.234 0.272 0 CA-C-O 119.752 -0.166 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.2 p -70.75 -32.09 69.13 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.408 0.683 . . . . 0.0 110.287 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.424 HG21 HG11 ' A' ' 129' ' ' VAL . 31.2 m -139.3 167.34 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.315 1.046 . . . . 0.0 109.173 -179.017 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -131.25 -27.94 1.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 117.369 -1.301 . . . . 0.0 110.591 173.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.77 165.66 29.98 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 120.179 1.354 . . . . 0.0 112.123 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.9 mt -135.03 136.85 51.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 169.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -133.57 149.75 51.64 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.5 mt -138.32 118.86 15.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 104.276 -2.49 . . . . 0.0 104.276 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 55.9 mt -122.71 144.92 48.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 -175.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.5 169.11 6.42 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.086 0.47 . . . . 0.0 110.519 169.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.78 -11.97 1.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.0 3.49 13.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.049 1.34 . . . . 0.0 110.743 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.16 6.41 55.69 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.09 1.328 . . . . 0.0 112.85 171.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.79 128.08 35.38 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 119.564 1.682 . . . . 0.0 109.869 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -60.9 120.83 10.93 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -101.96 -41.73 6.36 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 166.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -145.81 151.99 38.8 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.53 144.53 15.47 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 168.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -148.2 147.85 29.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -132.7 145.61 51.18 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -131.6 1.15 4.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.295 1.038 . . . . 0.0 111.493 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -134.05 162.62 31.59 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.925 0.89 . . . . 0.0 108.914 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -71.78 4.2 3.48 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.495 1.918 . . . . 0.0 113.611 -169.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -62.24 -48.5 79.66 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.445 1.098 . . . . 0.0 111.275 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -143.94 74.99 16.1 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 124.162 0.985 . . . . 0.0 108.989 -176.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.23 -1.88 6.96 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.582 2.188 . . . . 0.0 113.568 -172.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.6 m -134.22 139.21 45.63 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.098 0.959 . . . . 0.0 109.238 -169.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -43.73 -52.85 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.431 1.893 . . . . 0.0 112.98 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.99 -42.11 98.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.464 0.575 . . . . 0.0 111.28 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.27 -34.62 73.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -64.85 -49.81 69.08 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.289 0.635 . . . . 0.0 110.292 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.56 -35.69 70.66 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.449 -0.782 . . . . 0.0 111.033 177.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.44 -43.58 73.02 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.961 0.505 . . . . 0.0 109.932 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -62.43 -37.88 87.56 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.071 -0.393 . . . . 0.0 110.759 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -64.99 -43.12 93.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.72 1.608 . . . . 0.0 111.005 178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -59.27 -46.58 88.13 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.267 0.485 . . . . 0.0 109.86 172.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -46.67 83.58 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.731 0.812 . . . . 0.0 111.1 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.3 mm -57.43 -53.52 42.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 124.417 1.087 . . . . 0.0 108.344 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.46 -48.4 81.94 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.651 0.38 . . . . 0.0 110.366 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -56.95 -43.67 81.78 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.031 0.932 . . . . 0.0 111.911 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -76.36 -48.9 18.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.053 0.541 . . . . 0.0 109.937 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.9 p -65.96 -30.23 70.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.672 -0.642 . . . . 0.0 112.048 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -56.64 -24.42 48.09 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.486 -0.758 . . . . 0.0 111.782 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -110.64 21.41 16.6 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.31 1.444 . . . . 0.0 110.485 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.7 m -128.87 153.51 47.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.392 1.077 . . . . 0.0 109.322 -173.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -83.21 93.79 7.74 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.182 0.993 . . . . 0.0 109.048 176.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -45.4 140.85 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.468 1.907 . . . . 0.0 115.96 -171.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 144.73 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 1 C-N-CA 133.223 4.609 . . . . 0.0 107.231 170.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -151.92 156.93 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.833 1.253 . . . . 0.0 109.041 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 171.75 17.61 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.398 2.279 . . . . 0.0 107.559 173.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 tt -142.23 117.7 10.27 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.86 -1.904 . . . . 0.0 105.86 169.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 mp -111.94 103.75 11.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -169.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 61.34 -2.25 0.24 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.196 2.198 . . . . 0.0 115.324 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.8 -27.91 1.3 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 126.021 1.772 . . . . 0.0 111.33 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -85.77 132.64 34.09 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 118.314 1.057 . . . . 0.0 108.873 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 m -82.82 140.67 32.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 175.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 89.7 t -139.21 138.24 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -173.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.9 m -123.91 149.77 28.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -157.32 165.99 34.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.503 0.668 . . . . 0.0 111.876 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -151.16 159.6 44.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 127.305 2.242 . . . . 0.0 106.641 -169.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -138.42 144.45 40.18 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.7 m -138.74 119.65 14.34 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.039 1.336 . . . . 0.0 108.432 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.3 mp 62.58 -76.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 126.781 2.032 . . . . 0.0 113.061 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -143.39 21.84 1.86 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.607 1.563 . . . . 0.0 109.943 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.89 149.99 52.29 Favored 'General case' 0 N--CA 1.458 -0.075 0 C-N-CA 125.616 1.566 . . . . 0.0 109.387 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -130.4 142.18 50.52 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.983 1.313 . . . . 0.0 108.183 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -124.08 142.78 50.9 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.349 1.459 . . . . 0.0 107.087 -177.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -142.98 147.82 35.8 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.76 0.824 . . . . 0.0 109.251 -176.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.91 138.41 50.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.95 136.96 57.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 -172.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.07 -179.5 27.75 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-O 122.133 0.852 . . . . 0.0 112.192 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.4 m -59.62 165.89 2.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.696 1.599 . . . . 0.0 112.192 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -67.66 6.6 0.62 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.919 1.688 . . . . 0.0 114.541 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.29 122.94 17.85 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -175.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.16 -18.69 63.74 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.081 1.352 . . . . 0.0 114.555 -169.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -66.2 -32.43 73.86 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.705 -170.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.282 2.0 pp20? 48.39 -10.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.23 3.012 . . . . 0.0 118.463 -176.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 33.2 mt -63.8 -32.22 73.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 120.441 -1.412 . . . . 0.0 111.18 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -33.96 77.08 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.185 0.902 . . . . 0.0 111.532 174.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.3 mt -68.65 -47.35 66.77 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 19.2 mmt -55.4 -41.59 72.92 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.458 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.1 -51.69 66.92 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.282 0.633 . . . . 0.0 109.503 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.45 -44.81 99.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.223 0.465 . . . . 0.0 110.34 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.3 tp -61.31 -49.28 77.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.329 0.513 . . . . 0.0 110.471 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -65.21 -40.59 94.36 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.412 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.6 m -61.68 -46.94 87.56 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.442 0.565 . . . . 0.0 110.091 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.26 -51.35 66.52 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 118.55 0.613 . . . . 0.0 110.033 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -58.07 -47.18 83.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.215 0.606 . . . . 0.0 111.427 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -79.9 -29.21 39.83 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.474 -0.766 . . . . 0.0 111.894 -173.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.2 t -68.62 -43.55 76.11 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 119.249 0.931 . . . . 0.0 110.085 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 37.2 mt -53.33 -49.81 66.3 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 169.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.0 m -60.13 -32.01 70.61 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.22 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 35.3 mm-40 -65.82 -62.26 1.6 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 120.013 1.278 . . . . 0.0 109.513 174.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -72.65 -36.55 68.01 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -169.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.578 HD21 ' HB1' ' A' ' 113' ' ' ALA . 20.1 tp -73.88 -30.94 62.91 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.847 0.294 . . . . 0.0 111.352 -172.224 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 58.27 28.14 16.22 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.171 1.388 . . . . 0.0 113.08 172.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -150.15 176.56 10.73 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.935 2.094 . . . . 0.0 106.705 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -55.01 129.74 39.05 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.385 0.674 . . . . 0.0 109.719 169.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.419 HG12 HD23 ' A' ' 105' ' ' LEU . 24.5 m -81.5 48.06 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 109.727 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.11 176.74 4.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.124 -0.985 . . . . 0.0 111.737 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -46.84 -57.87 4.48 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.364 1.866 . . . . 0.0 112.836 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -64.8 -37.42 87.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.368 0.531 . . . . 0.0 110.674 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.578 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -68.26 -32.61 72.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.409 0.284 . . . . 0.0 110.879 -177.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.5 mp -75.02 -38.54 61.49 Favored 'General case' 0 CA--C 1.514 -0.404 0 O-C-N 120.594 -1.316 . . . . 0.0 111.821 172.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.7 tp -55.96 -39.28 71.55 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.48 0.582 . . . . 0.0 110.62 174.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -75.87 -10.57 59.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.33 24.93 4.16 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.726 1.148 . . . . 0.0 113.246 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -43.97 -44.9 7.51 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.042 1.337 . . . . 0.0 112.233 177.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.73 -40.73 95.82 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.042 0.837 . . . . 0.0 111.776 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.48 -42.95 98.82 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 176.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -55.75 -49.02 74.23 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.112 0.965 . . . . 0.0 110.449 172.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -58.03 -45.84 86.28 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.622 0.646 . . . . 0.0 109.851 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.09 -37.45 85.81 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 119.118 -0.468 . . . . 0.0 111.356 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.38 90.42 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 119.016 0.825 . . . . 0.0 110.096 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.97 -46.34 87.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.721 0.691 . . . . 0.0 109.746 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.7 -30.72 68.99 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.959 0.904 . . . . 0.0 112.661 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -85.79 -29.8 23.52 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.746 -0.596 . . . . 0.0 111.323 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 68.5 mt -78.99 -41.62 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.307 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' VAL . . . . . 0.424 HG11 HG21 ' A' ' 13' ' ' VAL . 0.9 OUTLIER -145.96 153.25 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 119.918 1.236 . . . . 0.0 110.836 -170.986 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -155.84 141.44 17.85 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.885 1.274 . . . . 0.0 108.799 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.61 25.08 54.85 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.423 -0.654 . . . . 0.0 114.125 173.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 86.35 8.81 77.24 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 118.077 0.939 . . . . 0.0 113.203 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.3 t -127.44 142.25 44.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 119.305 1.552 . . . . 0.0 106.953 -177.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -62.37 155.93 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.598 0.713 . . . . 0.0 110.33 171.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.6 mt -122.69 -23.41 5.12 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.919 1.688 . . . . 0.0 109.834 171.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -154.55 161.31 41.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.935 0.789 . . . . 0.0 109.315 173.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 9.1 p -144.74 34.17 1.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.406 1.482 . . . . 0.0 110.448 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.68 120.84 6.7 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.908 0.883 . . . . 0.0 109.924 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -64.73 -33.36 54.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.188 2.592 . . . . 0.0 114.608 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.292 2.5 pp0? -84.42 -27.38 27.63 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.09 0.859 . . . . 0.0 111.523 -176.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -68.74 -40.68 79.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.018 1.281 . . . . 0.0 108.755 168.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.3 t -55.09 -53.22 36.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 118.223 -0.894 . . . . 0.0 108.78 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.28 -37.12 79.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 119.966 1.257 . . . . 0.0 111.132 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 -48.44 81.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.584 0.629 . . . . 0.0 109.515 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -68.27 -34.74 76.73 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.853 0.751 . . . . 0.0 111.636 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 48.7 t -61.98 -43.81 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 119.182 0.901 . . . . 0.0 109.448 174.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.97 -32.12 73.14 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.506 0.594 . . . . 0.0 111.426 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 37.4 tp -73.16 -24.83 60.62 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.86 1.664 . . . . 0.0 112.293 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 . . . . . 0 C--O 1.25 1.123 0 CA-C-N 118.597 0.635 . . . . 0.0 110.257 172.728 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.235 0.334 0 CA-C-O 119.613 -0.232 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 32.4 p -71.34 -32.0 68.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 171.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.5 140.8 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -100.52 -25.25 14.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 117.513 -1.232 . . . . 0.0 109.787 171.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.1 167.77 23.72 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.768 1.167 . . . . 0.0 111.89 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mt -138.96 139.29 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mt -138.25 154.4 49.07 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.3 mt -138.05 120.46 18.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 103.814 -2.662 . . . . 0.0 103.814 168.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.9 mt -125.99 145.46 50.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -169.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 170.73 3.39 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.678 0.791 . . . . 0.0 110.905 170.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -63.48 2.33 0.44 Allowed 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -131.32 9.66 4.78 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.688 1.595 . . . . 0.0 110.738 175.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.09 19.97 48.22 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 118.645 -1.086 . . . . 0.0 113.095 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -78.34 132.68 37.52 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.778 1.789 . . . . 0.0 109.697 171.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 ttm180 -61.53 116.83 5.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.354 0.662 . . . . 0.0 109.673 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mt -85.53 -43.27 13.67 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 157.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -148.87 148.48 29.91 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.953 1.301 . . . . 0.0 108.188 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.03 146.7 14.41 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 3.3 mmpt? -141.28 149.14 40.88 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.65 1.58 . . . . 0.0 107.733 172.143 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -139.68 144.55 37.64 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.614 1.566 . . . . 0.0 107.596 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -135.0 -1.96 2.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.316 1.047 . . . . 0.0 112.041 -170.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -134.4 160.04 39.2 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.47 0.708 . . . . 0.0 109.447 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.95 3.89 4.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.846 2.059 . . . . 0.0 112.871 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -61.03 -47.62 85.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.663 1.185 . . . . 0.0 110.819 177.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -144.07 75.08 15.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.312 1.045 . . . . 0.0 108.888 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -90.03 -1.01 5.61 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.726 2.284 . . . . 0.0 113.687 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 m -134.34 137.87 44.49 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.017 0.927 . . . . 0.0 109.463 -169.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.7 t -46.09 -49.84 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.066 1.746 . . . . 0.0 112.866 -169.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.18 -47.68 82.67 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.559 0.618 . . . . 0.0 111.019 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -73.92 -32.47 63.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.148 0.431 . . . . 0.0 110.36 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -61.79 -51.15 69.45 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.089 0.555 . . . . 0.0 110.594 174.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.18 -35.55 75.62 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.354 -0.841 . . . . 0.0 110.85 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.53 78.59 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.57 -38.54 87.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 110.916 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.38 -42.75 99.66 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.465 1.506 . . . . 0.0 111.08 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -65.49 -41.97 92.66 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.583 0.629 . . . . 0.0 109.985 174.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.89 -46.16 78.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.052 0.541 . . . . 0.0 111.11 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.9 mm -60.56 -52.4 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -60.44 -46.01 91.6 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.742 0.701 . . . . 0.0 110.521 -177.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -55.66 -47.39 76.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.869 0.867 . . . . 0.0 111.628 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -67.69 -52.12 41.59 Favored 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 123.28 0.632 . . . . 0.0 110.227 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.401 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 36.2 p -70.7 -33.43 70.87 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.845 -0.534 . . . . 0.0 112.207 -169.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -64.71 -12.86 51.26 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.139 -0.976 . . . . 0.0 111.961 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -111.03 13.81 21.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.612 1.965 . . . . 0.0 111.361 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.8 m -120.33 159.48 24.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.556 1.142 . . . . 0.0 109.111 -176.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.24 31.84 0.45 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.675 1.59 . . . . 0.0 112.824 -169.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m 68.24 178.03 0.25 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.392 1.877 . . . . 0.0 113.603 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 11.1 pt-20 56.25 -44.05 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.415 3.886 . . . . 0.0 117.138 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -150.44 154.29 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 120.305 1.412 . . . . 0.0 109.259 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.15 163.8 36.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.839 2.056 . . . . 0.0 108.798 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.28 120.87 34.38 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -111.18 71.1 0.73 Allowed 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 126.167 1.787 . . . . 0.0 107.632 -172.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 62.84 7.95 2.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.533 1.533 . . . . 0.0 113.815 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 145.95 -33.91 1.47 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.327 1.918 . . . . 0.0 110.42 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.22 156.78 38.77 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.615 0.766 . . . . 0.0 109.141 170.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -117.06 138.77 51.39 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 77.8 t -136.33 139.31 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 -169.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.1 t -132.9 131.22 59.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.401 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 21.5 p90 -156.81 164.61 37.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -168.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 pttp -154.68 179.04 9.44 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.496 0.719 . . . . 0.0 109.232 169.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 p -138.34 146.06 41.89 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.4 m -147.9 146.03 28.88 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.461 1.104 . . . . 0.0 109.592 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 52.52 -83.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 127.03 2.132 . . . . 0.0 110.882 -172.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -152.81 29.43 0.52 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.82 2.048 . . . . 0.0 109.226 -176.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.2 tp -136.7 153.42 50.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.436 1.494 . . . . 0.0 110.27 -169.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -122.91 149.29 44.43 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.324 1.05 . . . . 0.0 109.125 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -136.89 141.56 42.75 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.587 1.555 . . . . 0.0 107.873 -172.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -145.18 150.24 36.39 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.074 0.95 . . . . 0.0 112.004 -169.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.4 t -137.19 138.74 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.51 137.91 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.7 -179.7 36.54 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.505 1.058 . . . . 0.0 113.006 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -172.94 0.67 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.595 -1.803 . . . . 0.0 109.658 175.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.8 t -142.35 161.34 38.27 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -155.23 -50.1 0.09 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.346 1.059 . . . . 0.0 109.285 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -150.4 -18.32 0.24 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.676 0.79 . . . . 0.0 111.828 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.2 p30 -155.48 171.74 19.41 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 123.823 0.849 . . . . 0.0 111.085 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -1.4 14.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.729 2.412 . . . . 0.0 110.518 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.35 -32.69 68.77 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.733 1.213 . . . . 0.0 111.697 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -34.34 76.39 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.722 0.692 . . . . 0.0 111.274 177.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -69.45 -43.45 73.25 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 46.0 mmm -59.72 -40.11 86.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.348 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.84 76.9 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.766 0.827 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.26 -43.18 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 118.583 -0.722 . . . . 0.0 110.185 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 tp -60.85 -48.51 81.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.112 0.869 . . . . 0.0 110.477 178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -62.7 -46.4 88.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 119.341 -0.362 . . . . 0.0 110.317 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 89.7 m -60.61 -46.73 89.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.911 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.2 tp -61.01 -52.36 65.33 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 119.187 0.903 . . . . 0.0 111.024 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -66.01 -40.62 91.26 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.065 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.12 -31.58 66.16 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.497 -0.752 . . . . 0.0 111.311 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 71.0 m -62.58 -49.84 73.66 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.614 0.765 . . . . 0.0 110.312 172.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 74.8 mt -53.07 -46.64 68.66 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.3 m -58.68 -41.12 85.46 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 118.552 -0.737 . . . . 0.0 112.104 178.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -67.39 -42.04 83.99 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 119.828 1.195 . . . . 0.0 111.419 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.0 ptp -76.75 -36.22 57.24 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.14 0.882 . . . . 0.0 111.622 -175.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.85 -33.95 24.74 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 118.663 0.665 . . . . 0.0 112.015 -173.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 50.15 29.9 3.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.591 1.156 . . . . 0.0 112.822 -176.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -154.84 -178.07 6.96 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 126.316 1.847 . . . . 0.0 107.486 169.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -53.78 121.17 7.35 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.511 0.672 . . . . 0.0 111.104 176.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.1 m -79.32 50.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.373 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.98 175.99 6.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.041 0.936 . . . . 0.0 111.974 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -46.88 -56.56 6.12 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.369 1.468 . . . . 0.0 112.279 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -62.37 -44.47 96.4 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.137 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.69 83.76 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.501 0.591 . . . . 0.0 110.329 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.25 -38.04 75.05 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 118.498 -0.763 . . . . 0.0 112.081 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.24 -38.38 76.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.903 0.774 . . . . 0.0 110.831 176.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -72.04 -14.71 61.94 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -125.06 21.34 8.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.506 1.048 . . . . 0.0 111.923 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -48.37 -49.51 34.34 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.444 1.098 . . . . 0.0 112.215 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.49 -36.49 81.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.617 0.644 . . . . 0.0 111.361 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.15 -43.88 98.5 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 173.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -61.2 -49.34 77.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.68 1.192 . . . . 0.0 110.845 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -53.17 -49.96 65.59 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.131 0.878 . . . . 0.0 110.068 175.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 65.0 mt -65.89 -41.38 91.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 119.179 -0.439 . . . . 0.0 111.037 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.52 93.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.598 0.636 . . . . 0.0 110.294 178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.9 t -57.81 -44.39 86.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 118.288 0.495 . . . . 0.0 109.702 175.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -66.77 -5.75 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.606 1.162 . . . . 0.0 113.63 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -112.15 -28.81 7.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.017 1.327 . . . . 0.0 110.555 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 82.5 mt -66.97 -43.17 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.453 1.024 . . . . 0.0 108.723 171.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.45 155.19 28.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 124.303 1.041 . . . . 0.0 109.856 -174.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -149.67 131.44 15.06 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.221 1.408 . . . . 0.0 107.814 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.22 30.78 55.65 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 119.28 -0.733 . . . . 0.0 113.201 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.59 12.56 84.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 118.268 1.034 . . . . 0.0 113.846 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 t -123.72 141.41 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.155 1.478 . . . . 0.0 107.038 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.0 pt -55.71 138.7 15.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.456 0.646 . . . . 0.0 110.174 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -122.1 -38.8 2.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.126 1.77 . . . . 0.0 108.564 -172.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.55 153.39 43.52 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 169.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.3 m -133.37 28.21 4.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.216 1.407 . . . . 0.0 110.305 -169.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -139.22 125.72 12.52 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.229 1.012 . . . . 0.0 108.71 176.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.23 -38.39 3.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.843 2.362 . . . . 0.0 113.71 -171.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -28.11 57.58 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.032 -1.043 . . . . 0.0 110.433 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 68.0 mm-40 -61.8 -50.41 72.41 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.326 0.966 . . . . 0.0 109.748 169.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 12.3 t -51.98 -57.14 4.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 124.103 0.961 . . . . 0.0 109.02 177.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.5 t -63.56 -43.68 98.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.756 -173.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -57.36 -52.57 64.83 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 118.44 0.564 . . . . 0.0 109.643 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -57.32 -47.14 82.31 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.113 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 33.1 m -75.9 -28.47 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-N 120.385 1.448 . . . . 0.0 112.031 -172.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.96 -35.31 62.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.526 0.603 . . . . 0.0 110.981 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 52.6 tp -67.9 -41.2 83.07 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.961 1.704 . . . . 0.0 111.27 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 124.478 1.111 . . . . 0.0 110.03 -179.373 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.235 0.338 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.3 p -73.19 -23.14 60.37 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.886 -176.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.3 m -138.87 163.04 27.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 C-N-CA 123.906 0.882 . . . . 0.0 108.754 173.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -123.04 -28.12 4.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 117.247 -1.358 . . . . 0.0 110.166 171.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.82 165.31 30.47 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 120.094 1.315 . . . . 0.0 112.144 175.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.3 mt -133.23 133.8 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 170.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -131.19 146.46 52.34 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.5 mt -142.69 114.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 103.419 -2.808 . . . . 0.0 103.419 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.2 mt -124.89 148.1 48.48 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.419 0.688 . . . . 0.0 109.318 -169.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.79 170.55 13.38 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.915 169.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -60.26 -17.15 40.06 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -99.56 -14.31 19.08 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.647 1.112 . . . . 0.0 110.939 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.58 12.22 13.48 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 125.674 1.606 . . . . 0.0 112.239 175.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.93 132.04 47.14 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.158 1.479 . . . . 0.0 109.751 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -68.23 82.59 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.716 1.607 . . . . 0.0 109.853 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.42 -47.95 77.22 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -148.99 150.68 33.25 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.682 0.793 . . . . 0.0 109.116 171.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.29 145.74 19.48 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 169.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -147.95 148.07 30.37 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -134.21 144.65 48.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -130.04 0.44 4.73 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.169 0.988 . . . . 0.0 111.514 -172.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -133.8 161.78 33.79 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.671 0.788 . . . . 0.0 109.244 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -72.68 4.9 3.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.476 1.91 . . . . 0.0 113.071 -169.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.8 p -62.67 -48.77 77.88 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.713 1.205 . . . . 0.0 110.954 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -143.24 73.36 17.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.311 1.045 . . . . 0.0 109.026 -176.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -88.28 -1.47 6.91 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.727 2.285 . . . . 0.0 113.582 -171.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.5 m -133.29 138.13 46.29 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.213 1.005 . . . . 0.0 109.012 -170.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -45.4 -50.59 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 126.133 1.773 . . . . 0.0 112.999 -169.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -60.28 -43.96 95.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.724 0.693 . . . . 0.0 111.07 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -71.53 -33.5 69.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.049 0.386 . . . . 0.0 110.104 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -62.32 -49.6 74.98 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.073 0.549 . . . . 0.0 110.047 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.37 -37.78 75.94 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.309 -0.869 . . . . 0.0 111.137 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.38 77.65 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.978 0.511 . . . . 0.0 109.681 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -61.94 -37.53 85.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.117 0.567 . . . . 0.0 110.914 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -63.74 -42.81 97.8 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.455 1.502 . . . . 0.0 111.059 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -62.61 -43.42 98.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.316 0.962 . . . . 0.0 109.812 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -48.76 77.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.979 0.512 . . . . 0.0 110.983 175.424 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.83 -51.99 63.46 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 C-N-CA 124.149 0.98 . . . . 0.0 108.969 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -59.34 -47.16 86.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.185 0.594 . . . . 0.0 110.107 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -60.21 -48.17 82.86 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.541 0.736 . . . . 0.0 111.361 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -70.13 -43.07 71.72 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.423 0.689 . . . . 0.0 110.827 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.8 p -67.5 -34.28 76.82 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.562 -0.712 . . . . 0.0 111.087 -176.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -65.51 -7.03 12.39 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.1 0.864 . . . . 0.0 112.853 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -119.11 25.02 10.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.689 1.996 . . . . 0.0 109.432 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.495 HG21 ' HB2' ' A' ' 60' ' ' ALA . 84.2 m -129.51 153.07 48.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.516 1.927 . . . . 0.0 107.211 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.99 -45.66 92.66 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.514 -173.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.5 m 145.81 -175.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 1 C-N-CA 132.458 4.303 . . . . 0.0 108.39 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.4 pt-20 57.76 -49.21 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 130.981 3.712 . . . . 0.0 116.413 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.1 tt -152.96 153.67 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 120.798 1.636 . . . . 0.0 110.484 -173.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.495 ' HB2' HG21 ' A' ' 55' ' ' THR . . . -145.5 159.93 42.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.227 1.411 . . . . 0.0 110.232 171.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -113.56 99.07 7.47 Favored 'General case' 0 CA--C 1.52 -0.204 1 N-CA-C 100.065 -4.05 . . . . 0.0 100.065 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.6 tp -65.32 -66.36 0.56 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.033 -168.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -146.22 6.97 1.01 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.332 1.853 . . . . 0.0 110.263 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.27 -41.46 1.25 Allowed Glycine 0 CA--C 1.526 0.744 0 C-N-CA 126.361 1.934 . . . . 0.0 108.283 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.9 mt -66.61 139.68 57.9 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 169.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.3 m -98.98 142.81 29.99 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.44 142.15 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 m -111.42 147.63 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 169.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -152.79 157.59 41.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.088 0.47 . . . . 0.0 110.73 174.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.443 ' HE2' ' CE2' ' A' ' 98' ' ' PHE . 18.1 ptmt -144.49 171.37 14.45 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 169.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 m -140.44 137.91 34.3 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -145.12 140.56 28.1 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.225 0.61 . . . . 0.0 109.864 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.9 mp 50.36 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 127.358 2.263 . . . . 0.0 111.374 -169.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -142.61 16.27 1.99 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.471 1.908 . . . . 0.0 110.492 -176.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.1 145.99 44.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.846 2.058 . . . . 0.0 108.097 -169.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.24 138.08 53.02 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -134.13 139.15 45.71 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.61 1.164 . . . . 0.0 108.039 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -144.78 147.11 32.53 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.862 0.865 . . . . 0.0 110.059 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 70.9 t -137.82 131.08 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.0 139.46 48.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 -172.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -157.39 179.23 33.3 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-O 122.58 1.1 . . . . 0.0 113.074 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -62.4 156.04 23.66 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.266 1.826 . . . . 0.0 112.73 -171.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -71.81 33.35 0.06 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 127.575 2.35 . . . . 0.0 112.325 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -70.96 179.0 2.9 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.846 1.658 . . . . 0.0 111.285 -172.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -63.96 -12.94 42.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.085 1.754 . . . . 0.0 113.333 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -146.04 163.69 34.46 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.137 0.975 . . . . 0.0 110.172 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -7.15 7.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.833 2.453 . . . . 0.0 110.298 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -56.99 -36.34 70.25 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.79 1.636 . . . . 0.0 110.368 177.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -64.78 -34.9 79.43 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.1 0.56 . . . . 0.0 112.161 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -47.71 69.03 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -42.68 67.69 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.201 1.0 . . . . 0.0 110.052 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.71 65.35 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.006 1.322 . . . . 0.0 110.212 -177.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.97 -44.04 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.136 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 65.9 tp -61.2 -48.04 83.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 118.506 0.593 . . . . 0.0 110.341 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.56 -44.45 96.31 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 119.126 -0.464 . . . . 0.0 110.406 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.6 m -61.47 -45.9 92.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.275 0.489 . . . . 0.0 110.473 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.71 -49.3 68.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.478 0.581 . . . . 0.0 109.968 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.443 ' CE2' ' HE2' ' A' ' 70' ' ' LYS . 51.3 t80 -62.23 -42.22 99.12 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.899 0.381 . . . . 0.0 111.114 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -69.62 -37.27 76.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.533 -0.73 . . . . 0.0 110.647 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.5 m -62.97 -44.79 95.07 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.731 0.696 . . . . 0.0 111.221 175.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.8 mt -52.55 -51.46 59.58 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.6 m -58.44 -40.41 82.5 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.602 0.564 . . . . 0.0 111.097 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -66.74 -44.34 81.76 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.59 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -81.54 -30.64 33.05 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.782 1.174 . . . . 0.0 112.179 -177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -75.78 -44.66 40.38 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 119.154 0.888 . . . . 0.0 111.907 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 50.85 34.65 10.66 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.23 1.012 . . . . 0.0 111.973 -170.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -152.8 -176.92 5.95 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.784 1.633 . . . . 0.0 108.15 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -50.29 126.33 14.64 Favored 'General case' 0 CA--C 1.522 -0.112 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 35.1 m -76.04 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.399 1.48 . . . . 0.0 110.002 169.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.04 174.78 9.47 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.425 1.09 . . . . 0.0 110.805 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -52.08 -48.62 64.59 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.614 1.166 . . . . 0.0 112.304 -170.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 41.7 tpt85 -65.88 -35.92 81.98 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.907 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.0 -39.23 66.2 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.733 0.697 . . . . 0.0 111.107 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.03 -45.97 86.09 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 121.563 -0.711 . . . . 0.0 109.351 171.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 67.3 tp -61.34 -38.38 86.71 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.202 0.601 . . . . 0.0 111.793 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -65.29 -28.11 69.1 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.94 21.85 9.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.803 0.729 . . . . 0.0 112.531 -169.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.56 -50.77 2.22 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 125.564 1.546 . . . . 0.0 112.691 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -65.58 -39.24 91.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.076 0.853 . . . . 0.0 111.541 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.74 -43.17 99.35 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.11 -49.42 77.94 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.123 0.969 . . . . 0.0 110.605 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.58 -46.87 80.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.758 0.708 . . . . 0.0 109.708 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -65.75 -40.05 91.69 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.084 -0.484 . . . . 0.0 110.749 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.98 96.6 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.981 0.81 . . . . 0.0 110.125 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.77 -46.11 90.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 118.923 -0.56 . . . . 0.0 109.727 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -63.42 -25.47 68.29 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -84.85 -40.03 17.6 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.626 -0.671 . . . . 0.0 111.228 173.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.37 -42.54 87.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 119.136 0.88 . . . . 0.0 109.799 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -139.05 150.07 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.072 0 CA-C-N 119.245 0.929 . . . . 0.0 110.592 -174.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -149.97 132.96 16.17 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 125.059 1.344 . . . . 0.0 108.365 177.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.74 25.98 56.77 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.506 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 79.56 14.27 81.47 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.299 1.049 . . . . 0.0 113.255 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 20.2 t -126.73 141.43 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 119.257 1.529 . . . . 0.0 107.388 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -57.31 138.67 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.658 0.742 . . . . 0.0 109.852 172.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -125.3 -36.63 2.47 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.321 1.849 . . . . 0.0 108.21 -172.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -140.19 156.63 46.43 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 169.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.3 m -151.21 39.34 0.67 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.302 -0.874 . . . . 0.0 110.936 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -140.71 120.19 8.55 Favored Pre-proline 0 C--O 1.234 0.284 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 -29.69 17.91 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.108 1.872 . . . . 0.0 111.622 -169.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -69.41 -42.65 74.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -66.61 -43.63 84.29 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 41.4 t -55.85 -55.14 19.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.473 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.9 p -63.96 -41.21 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 119.051 0.841 . . . . 0.0 110.556 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -64.01 -43.42 95.68 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.003 0.82 . . . . 0.0 110.235 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.07 -48.06 83.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.378 0.536 . . . . 0.0 110.307 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.9 m -73.68 -26.57 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 119.247 0.93 . . . . 0.0 111.387 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.89 -34.9 74.16 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.739 0.699 . . . . 0.0 111.2 172.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.3 mp -75.83 -30.27 58.92 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.02 0.928 . . . . 0.0 111.947 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 118.535 0.607 . . . . 0.0 109.835 175.074 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 . . . . . 0 C--O 1.236 0.366 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -72.38 -28.12 62.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.071 0.548 . . . . 0.0 110.688 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.49 164.01 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.335 1.054 . . . . 0.0 108.268 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -133.1 -31.75 1.25 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 117.589 -1.196 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.86 165.82 31.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.833 1.197 . . . . 0.0 111.352 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.1 mt -138.08 135.63 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.8 mt -136.03 149.15 48.69 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 58.3 mt -138.75 125.27 24.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.9 mt -127.41 147.05 50.28 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 123.967 0.907 . . . . 0.0 108.964 -169.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -65.68 169.12 6.69 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -68.31 -15.13 63.45 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.626 1.17 . . . . 0.0 110.856 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -76.75 -7.2 54.93 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.062 -1.024 . . . . 0.0 112.06 171.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.18 51.16 29.14 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -169.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -130.32 136.35 49.04 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.578 1.151 . . . . 0.0 109.067 -173.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -60.59 124.28 19.9 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.211 0.605 . . . . 0.0 110.147 -174.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.1 mt -102.48 -41.19 6.38 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 158.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -145.25 151.13 37.9 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.746 0.818 . . . . 0.0 109.413 172.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.99 144.48 13.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.913 0.885 . . . . 0.0 108.69 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -149.7 149.76 31.08 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.869 0.868 . . . . 0.0 108.854 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -135.21 144.27 46.85 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 126.093 1.757 . . . . 0.0 106.786 -174.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -132.85 -8.94 3.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.785 -170.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.33 20.98 7.34 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.248 0.931 . . . . 0.0 112.87 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.2 t70 63.83 12.77 7.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.281 1.832 . . . . 0.0 113.602 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 p -62.84 -44.35 96.38 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.886 1.274 . . . . 0.0 110.555 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -141.0 83.69 13.77 Favored Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 106.409 -1.701 . . . . 0.0 106.409 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -92.5 0.03 3.95 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.667 2.244 . . . . 0.0 113.625 -170.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.0 m -136.24 139.39 42.7 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.195 0.998 . . . . 0.0 109.062 -169.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.7 t -43.83 -53.78 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 126.17 1.788 . . . . 0.0 112.845 -169.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -62.26 -44.21 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.572 0.624 . . . . 0.0 111.05 -173.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.38 -36.12 78.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -64.0 -50.35 68.87 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -56.7 -37.33 70.77 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.47 -0.769 . . . . 0.0 110.954 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.58 -44.82 77.25 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.866 0.466 . . . . 0.0 109.966 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.19 -36.95 83.46 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.4 -0.333 . . . . 0.0 110.645 175.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -65.18 -39.13 92.48 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.558 1.543 . . . . 0.0 111.231 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -64.5 -44.48 90.82 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.474 -0.766 . . . . 0.0 109.919 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.03 -48.15 76.51 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.083 -0.484 . . . . 0.0 110.571 174.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -55.11 -53.93 29.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 124.771 1.228 . . . . 0.0 108.714 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -64.82 -45.96 83.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.088 0.404 . . . . 0.0 110.588 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.44 -44.62 92.9 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 121.938 -0.476 . . . . 0.0 111.315 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtm -64.83 -50.6 66.05 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.4 p -70.84 -30.08 66.4 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.427 -0.796 . . . . 0.0 112.495 -169.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.65 -14.23 60.79 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.73 1.15 . . . . 0.0 113.36 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.43 9.09 21.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.229 1.012 . . . . 0.0 112.321 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.2 m -111.62 157.6 20.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.431 1.092 . . . . 0.0 109.013 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -80.19 30.45 0.27 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.616 1.566 . . . . 0.0 112.971 -170.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.4 m 65.07 -176.8 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.338 1.855 . . . . 0.0 113.635 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.311 10.4 pt-20 56.57 -45.45 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 131.581 3.952 . . . . 0.0 116.84 -176.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.0 tt -154.07 152.49 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 120.626 1.557 . . . . 0.0 110.084 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.08 177.58 9.76 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.81 1.644 . . . . 0.0 108.422 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.5 tt -141.87 122.16 13.94 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 170.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.54 140.77 29.04 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.286 1.034 . . . . 0.0 109.878 -169.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 51.18 28.1 3.88 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.943 1.297 . . . . 0.0 112.215 -176.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.4 -3.27 87.23 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 125.205 1.383 . . . . 0.0 113.816 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.7 mt -106.57 135.26 48.39 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 119.395 1.598 . . . . 0.0 109.226 -174.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 m -73.58 141.46 46.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 173.018 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.5 p -141.05 137.2 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.702 -0.624 . . . . 0.0 109.699 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.44 148.11 11.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 105.512 -2.032 . . . . 0.0 105.512 169.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 29.2 p90 -155.81 163.79 39.37 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.046 0.451 . . . . 0.0 111.377 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.86 175.89 11.23 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -140.67 142.14 34.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 m -146.16 141.38 27.43 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.832 0.853 . . . . 0.0 109.016 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.4 mp 54.43 -83.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.735 2.014 . . . . 0.0 110.829 -173.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -152.63 28.52 0.55 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.393 1.877 . . . . 0.0 109.482 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.406 HD23 ' CZ ' ' A' ' 77' ' ' PHE . 57.5 tp -132.85 147.37 52.3 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.967 1.707 . . . . 0.0 109.121 -169.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -125.34 141.27 52.17 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.406 ' CZ ' HD23 ' A' ' 75' ' ' LEU . 18.3 m-85 -134.49 143.54 47.53 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.865 1.266 . . . . 0.0 108.582 -170.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -147.2 145.61 29.55 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.185 0.994 . . . . 0.0 110.933 -169.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 94.0 t -135.81 129.49 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 169.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -122.04 138.07 53.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 -169.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.66 -175.33 24.86 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 122.287 0.937 . . . . 0.0 112.211 -177.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.3 m -59.8 159.01 9.47 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.362 1.465 . . . . 0.0 112.28 -173.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.81 25.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 127.483 2.313 . . . . 0.0 112.599 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -73.07 -179.67 3.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.954 1.302 . . . . 0.0 112.495 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -113.61 29.98 7.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.513 1.525 . . . . 0.0 113.066 -169.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 88' ' ' LEU . 2.7 p30 -128.41 -39.51 1.67 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 116.563 -1.684 . . . . 0.0 113.592 169.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.251 8.6 pm0 49.79 -16.73 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 128.36 2.664 . . . . 0.0 117.441 -173.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' ' 86' ' ' ASN . 35.5 mt -58.98 -34.23 71.59 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 127.213 2.205 . . . . 0.0 110.893 177.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -65.57 -34.09 77.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.257 0.935 . . . . 0.0 111.738 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.0 mt -68.46 -46.88 68.6 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -53.18 -42.95 66.72 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.17 0.988 . . . . 0.0 109.958 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.33 -50.23 68.59 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.379 1.472 . . . . 0.0 110.265 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.67 -42.92 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 118.651 0.659 . . . . 0.0 110.168 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.76 -49.49 76.2 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.753 0.706 . . . . 0.0 110.488 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.06 -43.69 98.5 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.098 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.7 m -61.07 -46.1 92.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.529 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 tp -65.56 -46.4 79.64 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 119.756 1.162 . . . . 0.0 110.982 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -64.06 -42.82 96.88 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.031 0.443 . . . . 0.0 110.771 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -68.57 -38.81 81.04 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.536 -0.728 . . . . 0.0 110.959 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.1 m -60.9 -48.96 79.43 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.261 0.624 . . . . 0.0 110.666 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.7 mt -50.92 -49.29 59.93 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.844 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -68.23 -53.78 22.3 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.668 1.122 . . . . 0.0 111.032 178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 13.4 ptt? -70.63 -30.18 66.75 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.613 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.409 HD12 HG12 ' A' ' 109' ' ' VAL . 17.9 mt -75.99 -43.06 46.23 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.59 0.632 . . . . 0.0 112.171 174.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 51.54 36.22 16.49 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.505 1.122 . . . . 0.0 110.793 -169.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -150.05 170.9 17.8 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 127.074 2.149 . . . . 0.0 107.045 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -57.55 132.68 53.92 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.262 0.625 . . . . 0.0 109.799 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.409 HG12 HD12 ' A' ' 105' ' ' LEU . 3.9 m -89.37 42.08 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 124.579 1.152 . . . . 0.0 111.115 -169.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.6 178.02 1.09 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.619 1.168 . . . . 0.0 112.113 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -46.41 -54.63 8.75 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.455 1.102 . . . . 0.0 111.778 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -63.27 -42.15 99.11 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.715 0.234 . . . . 0.0 111.614 -176.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.312 0.0 OUTLIER -79.55 -31.98 42.08 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.409 -1.432 . . . . 0.0 111.254 175.861 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.99 -41.72 92.68 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.815 0.734 . . . . 0.0 111.269 170.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -74.48 -10.62 59.74 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.592 -0.693 . . . . 0.0 112.607 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.96 27.32 4.9 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.472 1.109 . . . . 0.0 112.878 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.1 mmt -43.17 -43.9 4.85 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.741 1.216 . . . . 0.0 112.723 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -63.81 -42.22 97.72 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.203 0.91 . . . . 0.0 111.211 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.3 96.4 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 tp -55.61 -51.9 65.61 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.844 1.257 . . . . 0.0 110.219 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -57.43 -47.32 82.1 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.013 0.525 . . . . 0.0 109.613 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 69.5 mt -65.0 -39.22 93.13 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.091 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.97 -44.33 89.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.843 0.747 . . . . 0.0 110.563 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 39.9 t -56.28 -48.24 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.53 6.8 0.98 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.52 1.528 . . . . 0.0 113.57 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -126.16 -23.28 3.91 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.743 1.617 . . . . 0.0 110.682 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 48.0 mt -84.35 -37.78 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.9 159.35 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 119.797 1.181 . . . . 0.0 111.239 -172.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -159.99 138.03 10.08 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.482 1.513 . . . . 0.0 108.366 169.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.59 26.53 57.3 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-O 119.434 -0.648 . . . . 0.0 114.464 171.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.49 13.77 75.28 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-N 118.215 1.007 . . . . 0.0 113.13 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 t -128.84 141.46 46.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 29.8 pt -64.16 158.95 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.734 0.778 . . . . 0.0 110.071 170.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.7 mt -116.98 -39.9 3.19 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.714 1.606 . . . . 0.0 108.769 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -155.68 160.97 40.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.624 1.169 . . . . 0.0 108.419 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.5 p -138.03 37.88 2.35 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.658 1.583 . . . . 0.0 109.799 -173.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -136.1 120.13 12.75 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.48 -34.11 6.14 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.355 2.037 . . . . 0.0 112.149 -170.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -67.23 -45.66 76.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -65.73 -38.73 89.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.668 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 5.0 t -56.48 -53.58 38.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 119.141 0.882 . . . . 0.0 109.895 173.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 70.7 t -64.57 -36.49 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.725 1.148 . . . . 0.0 110.372 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.32 -50.81 72.29 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.989 0.813 . . . . 0.0 110.239 174.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.1 mtt-85 -59.54 -43.46 93.51 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 111.102 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 51.1 t -59.0 -43.6 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.624 1.102 . . . . 0.0 110.048 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.2 -32.66 70.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.024 0.53 . . . . 0.0 111.691 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.9 tp -73.49 -28.65 62.04 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.268 1.827 . . . . 0.0 112.268 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 123.735 0.814 . . . . 0.0 109.891 175.643 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 . . . . . 0 C--O 1.235 0.293 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 m -71.94 -38.75 69.76 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 168.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -141.78 135.26 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 126.452 1.901 . . . . 0.0 106.555 175.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -92.55 -36.66 12.91 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 0.0 110.736 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.67 167.29 28.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.996 0.816 . . . . 0.0 111.947 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.3 mt -135.33 135.4 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 104.893 -2.262 . . . . 0.0 104.893 171.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.6 mt -133.02 148.68 52.24 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.469 ' CG2' HD11 ' A' ' 75' ' ' LEU . 57.5 mt -136.78 113.18 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 102.763 -3.051 . . . . 0.0 102.763 169.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.2 mt -122.06 146.95 46.7 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.401 0.68 . . . . 0.0 109.678 -169.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.41 169.81 5.53 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 168.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -14.87 59.75 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.38 1.072 . . . . 0.0 112.413 173.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -75.22 -9.33 58.45 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.193 0.997 . . . . 0.0 112.139 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.83 51.47 15.09 Favored Glycine 0 C--N 1.339 0.737 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -140.06 133.45 29.97 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.259 1.023 . . . . 0.0 108.684 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 124.84 22.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.279 0.491 . . . . 0.0 111.609 -170.212 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.8 mt -82.45 -37.42 25.44 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 153.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -145.55 151.97 38.98 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.055 1.342 . . . . 0.0 108.853 170.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -154.7 147.57 24.49 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -138.34 135.16 35.1 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 171.429 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -123.54 129.77 51.68 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -103.66 -24.51 13.36 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -55.07 158.46 2.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.086 2.554 . . . . 0.0 112.575 169.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -119.52 1.39 11.16 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.795 1.638 . . . . 0.0 111.867 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 m -75.81 -35.25 60.08 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.792 1.237 . . . . 0.0 110.084 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -130.15 67.91 80.37 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 125.287 1.435 . . . . 0.0 108.784 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -89.14 -1.38 6.21 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.814 2.343 . . . . 0.0 113.713 -173.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 m -137.63 148.92 46.2 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.894 0.878 . . . . 0.0 110.313 -169.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.7 t -45.54 -53.61 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 126.327 1.851 . . . . 0.0 112.733 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -54.61 -47.94 72.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 118.593 0.633 . . . . 0.0 111.064 -175.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -75.47 -34.16 60.88 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 -176.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -63.07 -46.81 85.7 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.815 0.846 . . . . 0.0 110.625 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -63.86 -34.24 77.49 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.281 0.946 . . . . 0.0 111.068 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -47.22 78.33 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.903 -0.498 . . . . 0.0 109.897 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -61.6 -40.02 93.3 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.95 0.9 . . . . 0.0 110.805 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -57.41 -49.9 74.74 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.654 1.581 . . . . 0.0 111.168 172.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -62.4 -40.96 98.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.808 1.186 . . . . 0.0 110.53 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -48.46 77.96 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.028 0.531 . . . . 0.0 110.641 173.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.6 mt -60.85 -48.05 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.08 0 C-N-CA 123.712 0.805 . . . . 0.0 109.481 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -58.84 -45.91 88.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.484 0.714 . . . . 0.0 110.158 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -63.02 -42.13 99.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.857 0.463 . . . . 0.0 112.066 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -68.86 -50.46 49.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.885 0.474 . . . . 0.0 110.471 -177.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.5 p -61.55 -35.15 76.96 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 123.733 0.813 . . . . 0.0 112.89 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.45 0.3 3.11 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -119.93 33.48 5.6 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.307 1.443 . . . . 0.0 109.761 -171.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.4 p -135.97 -174.4 3.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.069 0.948 . . . . 0.0 111.116 -169.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -78.63 6.02 9.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.77 1.228 . . . . 0.0 111.814 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m 68.79 31.25 4.51 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.264 1.826 . . . . 0.0 115.347 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.46 -16.69 4.31 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.917 0.487 . . . . 0.0 111.154 169.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.1 tt -164.74 156.28 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.361 1.064 . . . . 0.0 109.127 -171.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.82 171.81 14.62 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.351 1.861 . . . . 0.0 108.965 170.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -131.94 116.76 17.56 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.5 mt -78.15 -128.49 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.18 1.392 . . . . 0.0 108.535 -175.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -82.16 2.47 31.38 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.127 -0.983 . . . . 0.0 111.698 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.16 -33.29 0.51 Allowed Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.951 1.739 . . . . 0.0 110.474 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.0 mt -67.06 155.42 38.73 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.836 0.854 . . . . 0.0 109.423 173.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 55.8 m -112.45 145.2 40.6 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -138.56 130.32 37.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.0 m -97.45 146.04 8.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -156.49 167.14 31.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.124 0.42 . . . . 0.0 111.021 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -155.19 178.59 10.03 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.616 1.166 . . . . 0.0 108.103 169.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.1 p -142.42 148.59 38.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.91 0.484 . . . . 0.0 109.847 170.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.1 m -146.74 143.21 28.53 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.833 1.253 . . . . 0.0 108.936 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.2 mp 52.5 -87.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.507 1.923 . . . . 0.0 111.141 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -144.9 16.86 1.59 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.589 1.956 . . . . 0.0 109.76 -178.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.469 HD11 ' CG2' ' A' ' 18' ' ' ILE . 23.4 tp -120.22 144.07 47.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.971 2.108 . . . . 0.0 108.397 -169.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -122.55 146.02 47.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -135.51 137.47 42.14 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 -171.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -146.66 150.64 35.82 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.883 0.873 . . . . 0.0 110.529 -171.195 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 83.9 t -140.39 129.75 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.53 144.13 27.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -162.2 -175.76 33.57 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 121.814 0.674 . . . . 0.0 112.203 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 155.31 23.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.192 1.397 . . . . 0.0 111.343 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -56.23 -46.61 79.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.189 0.996 . . . . 0.0 110.677 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 15.0 t80 51.07 -169.83 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.204 2.202 . . . . 0.0 112.935 173.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -82.72 -18.29 41.34 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.356 -0.84 . . . . 0.0 111.405 175.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -157.49 176.94 12.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 125.478 1.511 . . . . 0.0 109.662 -175.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.79 4.18 8.13 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.119 2.167 . . . . 0.0 110.512 -174.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.8 mt -69.63 -32.4 71.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.558 1.143 . . . . 0.0 111.093 -173.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -34.16 77.53 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.248 0.931 . . . . 0.0 111.149 173.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.1 mt -66.76 -48.3 69.52 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.8 mmt -54.34 -42.85 70.71 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.029 0.531 . . . . 0.0 110.335 174.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.6 84.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.707 0.803 . . . . 0.0 110.502 -177.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.72 -43.67 96.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.062 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.9 tp -61.2 -49.15 78.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.131 0.878 . . . . 0.0 110.417 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -63.48 -42.91 98.55 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.306 -178.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.56 -51.89 67.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.66 -47.52 83.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.439 0.563 . . . . 0.0 110.26 -176.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -65.4 -40.16 93.06 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.976 0.353 . . . . 0.0 111.497 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -71.72 -32.87 68.23 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.266 -0.896 . . . . 0.0 111.191 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -61.06 -49.89 75.5 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.685 0.794 . . . . 0.0 110.268 174.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.8 mt -52.44 -51.24 60.23 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -59.05 -19.68 46.32 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -84.78 -55.08 4.28 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 120.637 1.562 . . . . 0.0 110.44 171.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 23.0 ptt? -78.11 -7.44 57.0 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -171.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 30.0 tp -144.68 59.35 1.32 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 127.291 2.236 . . . . 0.0 106.124 -171.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -52.55 -17.69 1.37 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.092 . . . . 0.0 114.929 -170.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -66.14 -166.15 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.45 1.023 . . . . 0.0 111.217 170.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -76.8 9.13 3.05 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.257 24.0 m 42.76 41.69 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 125.84 1.656 . . . . 0.0 112.914 -175.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -75.52 176.16 7.84 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.262 1.025 . . . . 0.0 111.184 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -49.85 -49.59 48.62 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.133 0.973 . . . . 0.0 112.972 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -62.9 -40.37 97.36 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.037 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.19 94.24 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.509 0.595 . . . . 0.0 110.305 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -59.78 -49.76 76.45 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.874 0.87 . . . . 0.0 110.107 175.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.33 -40.43 74.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.693 1.197 . . . . 0.0 110.98 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.87 -14.12 62.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.822 0.849 . . . . 0.0 113.086 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -133.72 22.38 3.93 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.919 0.887 . . . . 0.0 112.284 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.3 mmt -45.6 -45.37 13.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.301 1.44 . . . . 0.0 111.872 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.85 -40.29 94.92 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.433 1.015 . . . . 0.0 111.7 -177.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.0 -42.23 94.81 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 177.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 tp -57.09 -51.26 69.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.235 1.014 . . . . 0.0 110.493 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -55.5 -46.86 76.92 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.337 0.655 . . . . 0.0 109.286 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.57 -41.83 96.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.893 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -59.82 -45.35 92.66 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.613 1.097 . . . . 0.0 110.496 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.26 -42.71 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.616 0.644 . . . . 0.0 109.831 175.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -66.17 -26.34 67.37 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.376 0.67 . . . . 0.0 112.804 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -79.47 -34.67 41.23 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.163 0.892 . . . . 0.0 110.892 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 81.4 mt -79.56 -40.36 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.015 -174.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.6 t -133.9 145.56 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.302 0.955 . . . . 0.0 110.166 -169.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -146.16 131.92 19.0 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.415 1.486 . . . . 0.0 107.456 169.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.56 25.1 54.73 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 123.555 0.598 . . . . 0.0 113.705 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.09 22.92 78.65 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.241 1.02 . . . . 0.0 113.387 -177.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 58.5 t -128.73 140.43 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 176.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.0 pt -69.08 159.36 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-O 121.377 0.608 . . . . 0.0 110.395 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.8 mt -121.71 -34.2 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.136 1.375 . . . . 0.0 109.512 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -156.09 158.18 37.29 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.743 1.217 . . . . 0.0 108.477 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.5 m -135.5 -3.81 2.35 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.664 1.585 . . . . 0.0 111.627 177.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -77.26 116.34 56.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 119.316 0.962 . . . . 0.0 108.743 169.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.65 -33.91 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.563 2.176 . . . . 0.0 112.109 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -68.04 -44.41 76.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -68.36 -34.57 76.31 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.171 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.76 -51.6 68.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 119.182 0.901 . . . . 0.0 109.587 170.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 63.8 t -63.19 -36.92 77.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.768 1.167 . . . . 0.0 110.613 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -46.84 87.95 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.197 0.908 . . . . 0.0 110.154 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 48.0 mtp180 -60.01 -44.51 94.54 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.089 175.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 78.1 t -58.48 -46.33 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 119.697 1.135 . . . . 0.0 109.707 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.53 -33.11 74.4 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.358 0.663 . . . . 0.0 111.663 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 64.7 tp -71.35 -31.42 67.32 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.93 1.692 . . . . 0.0 111.644 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.947 175.651 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 . . . . . 0 C--O 1.236 0.373 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -68.33 -31.08 70.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.428 0.558 . . . . 0.0 109.622 176.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.49 125.97 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 169.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.443 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 65.1 mttm -81.05 -32.18 34.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 117.986 -1.007 . . . . 0.0 109.091 171.162 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.56 168.15 26.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.961 0.8 . . . . 0.0 111.735 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.9 mt -136.65 138.02 46.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 104.303 -2.48 . . . . 0.0 104.303 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mt -137.0 151.0 48.47 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -138.19 120.2 18.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 103.343 -2.836 . . . . 0.0 103.343 169.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.7 mt -126.05 147.0 49.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.45 169.41 6.01 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.181 0.515 . . . . 0.0 110.845 171.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -9.66 0.65 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 116.572 2.064 . . . . 0.0 116.572 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -119.95 9.37 11.24 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.145 1.378 . . . . 0.0 110.586 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.24 19.6 54.83 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.635 1.112 . . . . 0.0 112.469 173.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.4 133.28 39.94 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.358 1.579 . . . . 0.0 109.671 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -55.89 126.02 23.9 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.111 0.965 . . . . 0.0 108.98 176.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.3 mt -116.81 -45.73 2.77 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 165.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -143.83 152.69 41.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.54 148.63 19.76 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -141.7 136.12 30.52 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 171.075 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -125.73 146.82 49.59 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -130.61 -34.11 1.58 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.914 0.886 . . . . 0.0 111.329 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -78.93 159.59 27.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 172.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -78.53 7.79 6.19 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.935 1.694 . . . . 0.0 111.95 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 p -64.69 -45.99 84.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.244 1.418 . . . . 0.0 111.42 -177.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.9 70.88 29.5 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.338 1.055 . . . . 0.0 109.213 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -86.26 -1.46 8.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.573 2.182 . . . . 0.0 113.538 -173.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.8 m -134.52 138.35 44.59 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.126 0.97 . . . . 0.0 109.684 -169.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.0 t -46.31 -49.05 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.299 1.839 . . . . 0.0 112.937 -169.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -57.15 -46.57 82.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.383 0.538 . . . . 0.0 110.816 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.27 -32.07 60.93 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.286 -0.259 . . . . 0.0 110.349 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -62.72 -51.25 67.92 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 122.941 0.496 . . . . 0.0 110.203 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -59.64 -34.29 72.61 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.566 -0.708 . . . . 0.0 110.764 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.1 -47.28 74.72 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.745 0.418 . . . . 0.0 109.954 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -61.14 -36.63 80.29 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.829 0.451 . . . . 0.0 110.916 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -65.77 -40.94 92.51 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.17 1.388 . . . . 0.0 111.276 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -66.68 -39.24 88.04 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.245 0.93 . . . . 0.0 110.109 173.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -48.74 76.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.992 0.517 . . . . 0.0 110.622 171.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -56.74 -54.6 27.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.109 0 C-N-CA 124.475 1.11 . . . . 0.0 108.513 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -58.72 -48.78 79.97 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.328 0.651 . . . . 0.0 110.208 -176.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -60.74 -45.13 95.48 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.319 0.648 . . . . 0.0 111.894 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -70.02 -48.9 56.14 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 34.5 p -67.5 -28.18 67.62 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.591 -0.693 . . . . 0.0 112.088 -174.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.34 -18.76 60.19 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 118.796 0.725 . . . . 0.0 111.896 174.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtt-85 -113.76 19.22 16.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.751 1.62 . . . . 0.0 110.482 -172.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.3 m -131.49 154.44 48.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.759 1.224 . . . . 0.0 109.07 -169.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.79 88.73 4.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.31 1.044 . . . . 0.0 109.306 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.9 m -46.66 136.95 7.35 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 126.171 1.788 . . . . 0.0 115.808 -169.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.74 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 1 C-N-CA 133.031 4.533 . . . . 0.0 107.75 172.093 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 tt -153.43 158.92 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.386 1.474 . . . . 0.0 108.569 178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.34 165.04 34.28 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.72 2.008 . . . . 0.0 108.778 173.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -131.21 104.32 6.99 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 102.16 -3.274 . . . . 0.0 102.16 170.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -76.65 -64.87 1.02 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -168.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -141.77 6.55 1.83 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.837 1.655 . . . . 0.0 110.617 -173.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.4 -39.13 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 126.442 1.972 . . . . 0.0 109.169 -173.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.6 mt -72.98 132.98 44.11 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.406 0.682 . . . . 0.0 109.869 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.2 m -83.41 142.91 30.65 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.8 t -135.67 138.13 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.15 133.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.6 p90 -156.73 164.31 38.27 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -169.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -152.33 177.47 10.54 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.698 1.199 . . . . 0.0 108.989 172.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.0 p -143.66 147.87 34.94 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.255 0.622 . . . . 0.0 109.38 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.0 m -146.97 137.99 23.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.483 1.113 . . . . 0.0 108.894 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 mp 53.16 -84.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 127.483 2.313 . . . . 0.0 112.551 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -143.92 23.29 1.73 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.795 1.638 . . . . 0.0 109.552 -176.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 tp -132.04 145.35 51.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.63 1.572 . . . . 0.0 109.152 -169.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -125.85 146.11 49.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.41 138.45 46.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -144.3 148.81 35.29 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 123.568 0.747 . . . . 0.0 110.109 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -134.44 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 104.432 -2.433 . . . . 0.0 104.432 170.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.27 134.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -173.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.443 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -156.98 177.08 34.05 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-O 122.398 0.999 . . . . 0.0 113.172 -177.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.3 m -63.68 164.36 9.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 112.867 -1.666 . . . . 0.0 109.5 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -128.09 28.23 5.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.943 0.897 . . . . 0.0 110.597 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -60.37 -40.91 92.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.738 0.815 . . . . 0.0 112.968 -169.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -156.19 -23.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -145.9 165.77 27.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.339 0.972 . . . . 0.0 111.634 -171.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.8 -7.55 5.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.327 2.651 . . . . 0.0 110.326 177.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.66 -33.27 72.56 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.664 1.186 . . . . 0.0 110.775 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -64.09 -34.28 77.69 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.135 0.88 . . . . 0.0 111.819 174.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.22 -42.02 63.11 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.9 mmt -58.2 -40.75 82.37 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.521 171.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.06 -50.13 71.83 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.827 0.851 . . . . 0.0 109.815 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.42 -45.07 99.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 118.918 -0.563 . . . . 0.0 109.94 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 39.3 tp -60.47 -48.89 79.8 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.475 0.579 . . . . 0.0 110.304 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.46 -44.87 93.22 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.381 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 87.7 m -62.78 -43.85 97.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.523 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.9 tp -64.68 -51.73 60.93 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.785 0.72 . . . . 0.0 110.158 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -61.31 -42.04 97.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.396 0.278 . . . . 0.0 110.701 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.98 -38.56 66.62 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.593 -0.692 . . . . 0.0 111.483 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 m -61.51 -43.89 98.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.133 0.879 . . . . 0.0 110.379 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 mt -57.71 -45.76 85.31 Favored 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.2 m -61.4 -26.4 67.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.829 -0.605 . . . . 0.0 112.235 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -75.34 -53.13 9.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.819 1.19 . . . . 0.0 110.365 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 3.0 ptp -69.85 -39.42 76.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.012 0.824 . . . . 0.0 112.076 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.27 -37.82 60.76 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.532 0.606 . . . . 0.0 110.172 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 48.11 33.53 3.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.47 1.508 . . . . 0.0 113.028 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -153.31 -172.21 4.16 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.92 2.088 . . . . 0.0 107.421 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -50.0 122.9 7.26 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.804 0.842 . . . . 0.0 109.322 173.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 m -78.03 40.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 C-N-CA 125.029 1.332 . . . . 0.0 110.251 170.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.19 172.56 12.64 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.673 1.189 . . . . 0.0 112.231 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -43.77 -60.23 1.89 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.981 2.112 . . . . 0.0 112.874 -177.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -63.11 -46.11 88.87 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.726 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.71 82.08 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.943 0.792 . . . . 0.0 111.405 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.3 mp -74.14 -36.21 64.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.978 175.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.3 tp -58.63 -37.19 75.39 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.162 0.892 . . . . 0.0 110.956 171.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -73.9 -15.42 61.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 175.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -124.58 25.87 7.41 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.581 1.082 . . . . 0.0 111.454 -173.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.32 -48.63 18.25 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.908 1.283 . . . . 0.0 112.007 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.98 -39.51 94.3 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.721 0.691 . . . . 0.0 111.343 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.97 96.74 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.03 -50.6 72.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.609 1.163 . . . . 0.0 110.357 174.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -55.41 -48.07 74.93 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.028 0.531 . . . . 0.0 109.816 178.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.9 mt -65.56 -37.8 87.73 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.17 0.588 . . . . 0.0 111.397 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.37 -47.08 83.58 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 118.872 0.76 . . . . 0.0 109.906 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.95 -46.21 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.3 -2.92 4.92 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.125 1.37 . . . . 0.0 113.804 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -117.16 -12.94 10.52 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.749 1.22 . . . . 0.0 112.005 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 59.8 mt -87.9 -40.39 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.278 0.945 . . . . 0.0 108.503 173.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.32 156.24 21.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 124.936 1.294 . . . . 0.0 109.901 -172.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -149.8 136.44 19.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.252 1.421 . . . . 0.0 107.217 169.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.97 29.07 50.62 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 119.242 -0.755 . . . . 0.0 113.182 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.08 10.67 85.28 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 118.299 1.049 . . . . 0.0 113.835 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.12 133.33 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-N 119.079 1.439 . . . . 0.0 107.265 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.1 pt -57.77 145.15 9.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.085 0.554 . . . . 0.0 110.393 173.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -133.81 -14.22 2.46 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.202 1.001 . . . . 0.0 112.018 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -149.86 159.88 44.02 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.9 m -150.69 41.81 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.874 1.27 . . . . 0.0 109.464 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -139.94 119.86 9.05 Favored Pre-proline 0 C--O 1.235 0.325 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 173.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -30.82 13.18 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.056 1.837 . . . . 0.0 112.114 -169.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.18 -41.47 85.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -68.27 -42.1 80.08 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.473 0.579 . . . . 0.0 109.685 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 28.6 t -55.96 -55.8 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 118.845 -0.597 . . . . 0.0 109.471 176.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 5.2 p -65.26 -33.16 61.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 119.604 1.093 . . . . 0.0 110.798 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -60.59 -44.32 96.38 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.177 0.899 . . . . 0.0 110.566 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -63.57 -42.65 98.3 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.469 -0.769 . . . . 0.0 110.935 175.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.1 t -58.18 -42.2 82.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.968 0.804 . . . . 0.0 109.745 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.11 77.46 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.578 0.751 . . . . 0.0 111.902 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.94 -39.22 79.68 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.479 0.711 . . . . 0.0 111.386 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 54.9 mtp180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.427 -176.487 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 120.84 0.352 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.6 m -58.1 -35.56 71.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.699 1.599 . . . . 0.0 110.649 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -155.24 151.34 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -117.27 -30.42 5.6 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 117.585 -1.198 . . . . 0.0 111.747 -173.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.58 166.6 26.71 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 119.837 1.199 . . . . 0.0 111.656 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.1 mt -137.03 136.45 47.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -133.3 148.22 51.91 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.7 mt -139.06 118.18 13.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 169.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.4 mt -122.68 146.71 47.23 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -173.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 168.81 8.16 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.219 0.533 . . . . 0.0 110.31 169.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -12.23 1.54 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -115.97 3.64 13.69 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.94 1.296 . . . . 0.0 110.919 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.99 5.23 55.06 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.073 1.32 . . . . 0.0 113.084 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -69.8 133.76 47.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.426 1.613 . . . . 0.0 109.89 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -61.15 123.87 18.94 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 118.504 0.593 . . . . 0.0 109.653 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -100.08 -40.86 7.4 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 162.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -150.09 152.93 35.55 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.458 172.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.17 146.84 19.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 168.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.454 ' HE2' ' H ' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -147.46 146.78 29.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 170.437 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.454 ' H ' ' HE2' ' A' ' 29' ' ' LYS . 79.7 m-85 -133.6 151.72 51.75 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.969 1.708 . . . . 0.0 106.662 -177.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -135.92 1.4 2.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.869 0.868 . . . . 0.0 111.887 -175.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -133.68 158.31 43.59 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.737 0.815 . . . . 0.0 109.447 -176.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.52 5.19 3.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.358 2.263 . . . . 0.0 112.609 -173.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 p -62.21 -50.09 73.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.645 1.178 . . . . 0.0 110.532 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -142.68 64.71 15.84 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 124.193 0.997 . . . . 0.0 109.992 -174.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -82.18 -2.02 11.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.778 2.319 . . . . 0.0 113.598 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.5 m -138.01 143.68 40.71 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.914 0.886 . . . . 0.0 110.287 -169.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.8 t -45.62 -51.3 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 126.491 1.916 . . . . 0.0 113.127 -169.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -58.67 -46.64 86.75 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.799 0.727 . . . . 0.0 110.893 -176.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -70.37 -34.48 72.65 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.639 0.376 . . . . 0.0 110.165 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -63.2 -52.04 63.87 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.231 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -60.18 -35.35 75.17 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.894 0.77 . . . . 0.0 111.348 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.15 -49.92 70.24 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -63.4 -39.47 94.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.589 0.355 . . . . 0.0 111.023 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.07 -40.55 98.03 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.927 1.691 . . . . 0.0 111.564 178.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -69.32 -40.96 77.32 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.648 -0.657 . . . . 0.0 110.001 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.12 -48.78 73.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.979 0.512 . . . . 0.0 110.557 171.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.521 HD13 HD22 ' A' ' 62' ' ' LEU . 2.9 mm -54.86 -59.92 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 C-N-CA 125.133 1.373 . . . . 0.0 108.092 178.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -57.65 -45.33 85.62 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.629 0.772 . . . . 0.0 111.323 -172.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -57.84 -52.92 63.5 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 122.687 0.395 . . . . 0.0 110.507 176.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -63.9 -45.83 87.57 Favored 'General case' 0 C--O 1.23 0.062 0 CA-C-O 119.431 -0.318 . . . . 0.0 110.191 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.2 p -68.27 -32.06 71.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 119.205 0.911 . . . . 0.0 111.996 -172.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -73.51 0.55 12.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.442 1.019 . . . . 0.0 112.981 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -136.92 35.42 2.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.948 1.299 . . . . 0.0 110.451 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.3 m -135.88 156.98 47.95 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.387 1.875 . . . . 0.0 108.14 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -80.17 86.09 5.64 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.327 1.051 . . . . 0.0 109.055 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.7 m -50.57 144.27 8.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -169.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 145.45 -42.84 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 1 C-N-CA 133.553 4.741 . . . . 0.0 105.823 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -157.35 160.15 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.748 1.219 . . . . 0.0 108.973 -178.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.23 174.57 15.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.894 1.678 . . . . 0.0 110.207 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -136.7 116.89 13.46 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 176.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.521 HD22 HD13 ' A' ' 48' ' ' ILE . 10.2 mp -127.63 117.79 22.66 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.236 1.414 . . . . 0.0 107.296 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 50.68 31.49 5.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.121 1.368 . . . . 0.0 112.765 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.03 -16.03 61.59 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.859 1.218 . . . . 0.0 113.471 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.0 mt -91.21 134.15 34.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.456 1.628 . . . . 0.0 109.258 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 61.3 m -76.18 141.82 41.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 172.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.2 t -133.67 137.87 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -128.65 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 174.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -158.19 164.72 36.26 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.292 0.496 . . . . 0.0 112.218 -169.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -148.42 171.54 15.88 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.756 1.222 . . . . 0.0 108.352 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 p -145.47 143.91 30.29 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 169.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 17.1 m -147.24 142.89 27.71 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 109.665 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.4 mt 63.87 -81.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.382 1.873 . . . . 0.0 111.68 169.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -151.61 27.26 0.65 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.354 1.861 . . . . 0.0 109.151 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.2 tp -138.98 147.35 42.07 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.967 1.707 . . . . 0.0 110.062 -168.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -129.53 144.99 51.5 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.364 1.466 . . . . 0.0 107.454 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -132.85 137.19 46.63 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.433 1.493 . . . . 0.0 107.236 -172.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -146.13 151.19 37.27 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.728 0.695 . . . . 0.0 110.479 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.0 t -138.22 141.58 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 105.018 -2.215 . . . . 0.0 105.018 169.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.22 141.12 44.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 -172.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.89 -178.91 36.2 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 121.739 0.633 . . . . 0.0 113.062 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -62.57 164.8 7.04 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 113.973 -1.114 . . . . 0.0 110.205 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.1 m -124.68 43.96 2.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.866 0.866 . . . . 0.0 111.021 -169.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -71.91 -166.64 0.23 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 122.863 0.465 . . . . 0.0 110.21 169.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -58.41 -3.6 0.3 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 117.049 2.24 . . . . 0.0 117.049 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.69 167.69 25.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 120.27 1.396 . . . . 0.0 111.211 176.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.82 -0.91 2.78 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.486 2.715 . . . . 0.0 110.295 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.8 mt -63.65 -32.55 74.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.792 1.237 . . . . 0.0 109.937 -175.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -34.53 78.51 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.896 0.771 . . . . 0.0 111.355 175.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 mt -70.57 -45.19 65.87 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.5 mtp -58.94 -37.43 76.71 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.832 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.13 74.02 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.776 0.83 . . . . 0.0 110.364 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.6 t -59.05 -46.34 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.7 tp -58.05 -49.96 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.993 0.517 . . . . 0.0 110.366 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -63.6 -43.55 96.6 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 119.116 -0.469 . . . . 0.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.3 m -64.21 -42.18 96.73 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.491 0.587 . . . . 0.0 110.709 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.3 tp -67.93 -46.62 71.0 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.638 0.654 . . . . 0.0 110.241 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -62.34 -42.95 99.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.679 0.392 . . . . 0.0 111.046 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -76.58 -37.93 55.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.364 -0.835 . . . . 0.0 111.174 -176.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.7 p -63.13 -39.67 95.35 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.641 1.11 . . . . 0.0 110.442 175.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 11.6 mt -54.35 -52.64 60.96 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 m -56.21 -33.42 65.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.885 0.474 . . . . 0.0 111.928 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -69.25 -59.24 3.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.086 173.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.6 ptt? -69.6 -31.52 69.71 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.061 1.301 . . . . 0.0 113.472 -169.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.84 -35.42 74.73 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.824 0.738 . . . . 0.0 111.794 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? 49.08 33.29 4.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.424 1.09 . . . . 0.0 112.039 -171.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -155.21 175.66 13.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.076 2.151 . . . . 0.0 106.585 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -62.48 136.31 57.84 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -76.16 51.97 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.204 1.802 . . . . 0.0 111.02 -174.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.08 169.99 17.36 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.508 1.123 . . . . 0.0 111.745 -177.369 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -47.47 -55.42 9.09 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.366 1.866 . . . . 0.0 112.799 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -66.36 -38.27 87.19 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.221 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.76 -35.84 82.38 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.337 0.971 . . . . 0.0 110.864 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.99 -42.88 80.12 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 118.94 0.791 . . . . 0.0 110.685 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 58.1 tp -58.26 -37.4 74.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.667 0.667 . . . . 0.0 111.211 176.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -69.61 -18.45 63.61 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.104 0.962 . . . . 0.0 113.011 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -126.23 24.67 6.8 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.225 1.01 . . . . 0.0 111.525 -171.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -44.35 -49.34 9.6 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.475 1.51 . . . . 0.0 112.424 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.63 -42.48 98.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.205 0.911 . . . . 0.0 110.952 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.95 -43.88 98.24 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.14 -50.46 73.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.391 1.076 . . . . 0.0 110.837 175.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -55.06 -48.78 73.0 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.383 0.673 . . . . 0.0 109.871 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 97.1 mt -71.27 -32.27 68.5 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.416 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.46 -44.56 96.12 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.288 0.949 . . . . 0.0 109.71 173.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.35 -47.89 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 118.794 0.725 . . . . 0.0 109.638 174.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -61.12 -26.73 67.87 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -87.9 -28.95 21.22 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.118 0.967 . . . . 0.0 111.515 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.11 -43.35 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-N 119.089 0.859 . . . . 0.0 109.507 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 p -142.01 146.77 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.03 0.932 . . . . 0.0 110.39 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -144.49 138.93 27.95 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.02 1.328 . . . . 0.0 107.424 169.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.73 29.53 49.72 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.573 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.48 19.88 79.73 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 118.201 1.001 . . . . 0.0 113.417 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 61.3 t -130.94 133.59 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.6 pt -64.61 146.91 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.84 -12.35 3.75 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.888 0.875 . . . . 0.0 111.401 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.87 156.0 43.26 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 169.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.7 m -151.76 41.66 0.69 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.422 1.089 . . . . 0.0 109.735 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -142.36 120.5 7.44 Favored Pre-proline 0 C--O 1.235 0.299 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 174.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.81 -28.93 19.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.237 1.958 . . . . 0.0 111.775 -169.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -70.98 -39.96 72.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.78 -41.39 75.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 118.89 0.768 . . . . 0.0 109.609 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 42.1 t -55.3 -56.27 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.16 -34.6 71.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 118.979 0.809 . . . . 0.0 110.819 -174.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -59.17 -50.77 72.76 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.039 0.836 . . . . 0.0 109.904 176.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -62.05 -40.3 95.29 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.881 -0.512 . . . . 0.0 111.135 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 65.3 t -64.07 -37.48 79.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.777 0.717 . . . . 0.0 110.654 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.35 -37.71 71.67 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.755 1.162 . . . . 0.0 111.071 175.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.0 tp -70.18 -26.09 63.74 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.48 1.912 . . . . 0.0 112.698 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 C-N-CA 124.861 1.264 . . . . 0.0 112.184 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 . . . . . 0 C--O 1.234 0.269 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 m -65.35 -41.21 94.08 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 169.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -139.36 139.3 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 123.85 0.86 . . . . 0.0 108.739 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -83.53 -37.83 22.53 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 169.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.61 168.28 20.17 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 118.513 0.597 . . . . 0.0 112.125 -173.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mt -133.28 137.47 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 104.94 -2.244 . . . . 0.0 104.94 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.9 mt -133.76 157.7 45.2 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.521 0.728 . . . . 0.0 109.373 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.489 ' CG2' HD11 ' A' ' 75' ' ' LEU . 9.8 mm -138.31 119.77 17.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.368 -2.827 . . . . 0.0 103.368 169.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -122.54 144.73 48.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.705 0.764 . . . . 0.0 109.158 -174.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -67.87 169.7 9.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.767 169.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -77.22 36.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.883 2.073 . . . . 0.0 111.389 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -149.62 7.26 0.65 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.278 2.231 . . . . 0.0 110.816 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.19 47.1 74.9 Favored Glycine 0 C--N 1.343 0.946 0 O-C-N 121.053 -1.029 . . . . 0.0 110.548 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -122.99 133.26 54.37 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 108.873 -177.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -64.76 119.38 10.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -173.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.1 mt -92.42 -42.38 9.79 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 159.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -148.65 154.69 40.03 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.803 0.841 . . . . 0.0 109.886 171.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.11 148.98 22.56 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -140.88 137.09 32.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 171.593 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -124.26 146.87 48.49 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -130.09 3.83 4.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.751 0.82 . . . . 0.0 110.992 -176.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -136.49 153.13 51.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.667 0.787 . . . . 0.0 111.054 -174.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.37 -0.49 12.54 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.285 2.234 . . . . 0.0 113.076 -173.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 p -65.6 -38.21 88.8 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.992 -1.068 . . . . 0.0 111.578 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -143.41 64.69 14.1 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.031 0.832 . . . . 0.0 110.467 -177.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -86.78 -1.02 8.11 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.851 2.367 . . . . 0.0 113.083 -175.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.6 m -133.71 137.51 45.31 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.399 1.08 . . . . 0.0 109.224 -169.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -50.64 -44.41 25.4 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 125.048 1.339 . . . . 0.0 113.47 -169.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -57.98 -45.77 86.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.667 0.667 . . . . 0.0 111.135 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.08 -35.98 64.28 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -60.26 -52.56 64.77 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.178 0.591 . . . . 0.0 109.887 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -57.78 -39.73 78.18 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.595 0.758 . . . . 0.0 110.647 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.65 83.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.098 0.559 . . . . 0.0 110.184 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -64.08 -38.66 91.87 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.44 0.696 . . . . 0.0 110.952 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -60.21 -46.56 89.33 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.631 1.972 . . . . 0.0 110.711 174.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.89 -46.29 91.2 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.026 0.83 . . . . 0.0 110.228 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -47.04 77.65 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.503 0.721 . . . . 0.0 110.752 177.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.81 -51.34 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.035 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -60.66 -46.56 89.87 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.892 0.769 . . . . 0.0 110.272 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -55.37 -43.71 75.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.455 1.102 . . . . 0.0 111.736 178.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -75.24 -49.73 18.4 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.999 0.52 . . . . 0.0 110.417 -177.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.1 p -68.57 -30.66 69.47 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.731 -0.605 . . . . 0.0 111.887 -172.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -58.22 -23.85 57.16 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.291 -0.881 . . . . 0.0 111.541 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.41 20.95 17.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.487 1.515 . . . . 0.0 110.339 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 84.4 m -125.29 156.6 38.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 108.949 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -84.62 35.1 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.526 1.53 . . . . 0.0 112.679 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.7 m 65.86 -176.91 0.19 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.249 1.82 . . . . 0.0 113.446 178.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.312 9.6 pt-20 56.31 -42.11 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 131.536 3.934 . . . . 0.0 117.006 -176.155 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.7 tt -158.02 151.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 120.245 1.384 . . . . 0.0 110.024 -173.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.81 177.74 9.27 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.434 1.893 . . . . 0.0 108.291 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 tt -140.57 125.61 18.43 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 170.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -77.29 -65.88 0.9 Allowed 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -169.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -142.72 4.04 1.49 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.195 1.798 . . . . 0.0 110.915 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.48 -40.95 0.67 Allowed Glycine 0 CA--C 1.525 0.666 0 C-N-CA 125.773 1.654 . . . . 0.0 109.319 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.84 126.91 29.96 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 170.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.1 m -80.22 146.21 31.84 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.4 p -136.71 121.15 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.42 142.4 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.865 -2.642 . . . . 0.0 103.865 168.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.42 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 16.2 p90 -152.43 167.11 29.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.555 0.693 . . . . 0.0 110.892 176.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -154.78 154.26 32.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -172.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -140.01 130.93 26.1 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -149.92 148.21 28.83 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.179 0.591 . . . . 0.0 109.633 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.4 mp 53.28 -89.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.772 2.029 . . . . 0.0 111.147 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -147.6 33.97 0.86 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.772 2.029 . . . . 0.0 108.903 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.489 HD11 ' CG2' ' A' ' 18' ' ' ILE . 50.3 tp -140.19 150.65 44.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.69 1.596 . . . . 0.0 110.47 -168.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -126.28 144.76 50.68 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -129.61 143.83 51.0 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.284 1.834 . . . . 0.0 107.764 -173.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -149.52 150.35 32.17 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.459 1.027 . . . . 0.0 111.774 -172.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.5 t -139.58 119.66 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -104.53 138.01 31.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 106.187 -1.782 . . . . 0.0 106.187 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.68 176.73 31.54 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-O 122.369 0.983 . . . . 0.0 112.666 177.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.8 m -61.49 157.05 17.95 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.619 1.568 . . . . 0.0 112.328 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 m -72.92 34.38 0.07 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.01 2.124 . . . . 0.0 112.083 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -70.28 176.98 3.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.429 1.492 . . . . 0.0 111.355 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -63.96 -12.91 41.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.07 1.748 . . . . 0.0 112.963 -177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -144.75 161.61 38.8 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.85 0.86 . . . . 0.0 110.581 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -9.23 8.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.559 2.744 . . . . 0.0 110.202 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.23 -31.93 69.51 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.903 1.281 . . . . 0.0 110.609 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -64.56 -35.59 81.48 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.396 0.998 . . . . 0.0 111.96 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.96 -43.14 72.15 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 30.8 tpp -64.88 -33.88 77.05 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.131 0.572 . . . . 0.0 111.174 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.42 -50.41 67.7 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.749 1.22 . . . . 0.0 109.949 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.9 t -60.17 -44.97 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.336 0.516 . . . . 0.0 110.097 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.93 -53.01 63.17 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.339 0.656 . . . . 0.0 110.091 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -60.39 -43.54 96.56 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.884 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.15 -45.9 92.76 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.257 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.0 tp -64.37 -49.35 71.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.999 0.818 . . . . 0.0 110.406 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -59.46 -46.62 88.27 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.47 0.176 . . . . 0.0 110.847 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -69.23 -38.44 78.51 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 118.813 -0.613 . . . . 0.0 111.03 -176.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.1 m -59.5 -50.96 71.9 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.799 0.84 . . . . 0.0 110.803 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt -54.91 -45.97 74.82 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -61.33 -37.38 83.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.791 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -68.82 -55.51 10.95 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 120.091 1.314 . . . . 0.0 109.432 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -74.16 -36.97 64.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.699 -169.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.6 tp -82.93 -28.76 29.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.887 0.767 . . . . 0.0 111.918 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 40.11 54.01 2.74 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.771 1.628 . . . . 0.0 112.831 -171.052 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -135.16 -179.51 5.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.89 2.076 . . . . 0.0 106.914 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.06 -1.49 12.39 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 177.021 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.313 11.9 m 48.47 38.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.161 2.184 . . . . 0.0 111.87 -174.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -66.21 171.26 4.87 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.259 1.023 . . . . 0.0 110.023 171.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -60.54 -37.74 82.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -62.04 -45.47 93.41 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.495 1.043 . . . . 0.0 110.003 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.78 -33.1 73.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.512 0.325 . . . . 0.0 111.125 -174.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.326 0.0 OUTLIER -81.16 -32.93 33.42 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.518 -1.364 . . . . 0.0 110.95 176.37 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.3 tp -60.95 -36.74 80.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.293 0.951 . . . . 0.0 111.22 169.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.12 -7.96 59.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.319 -0.863 . . . . 0.0 112.845 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.82 30.79 5.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.457 1.103 . . . . 0.0 112.702 175.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -41.07 -46.08 2.84 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.167 1.387 . . . . 0.0 112.667 174.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.98 -40.55 96.65 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.056 0.843 . . . . 0.0 111.451 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.8 -42.79 98.4 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.58 -49.56 75.97 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.414 1.086 . . . . 0.0 110.543 173.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -56.09 -47.25 78.36 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 118.693 0.679 . . . . 0.0 109.734 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.5 mt -67.74 -36.98 81.53 Favored 'General case' 0 CA--C 1.527 0.072 0 CA-C-O 118.859 -0.591 . . . . 0.0 111.121 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.55 -45.37 93.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.076 0.853 . . . . 0.0 110.054 175.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.07 -49.4 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 118.673 0.67 . . . . 0.0 109.348 176.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.49 -23.29 62.64 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.415 1.086 . . . . 0.0 113.05 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -97.21 -19.59 18.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.655 1.182 . . . . 0.0 111.809 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 61.2 mt -88.79 -40.86 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.394 0.997 . . . . 0.0 109.474 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.2 m -140.32 145.27 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.97 1.308 . . . . 0.0 109.539 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -144.61 134.32 23.57 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.625 1.57 . . . . 0.0 107.302 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.44 28.67 51.48 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.369 -0.684 . . . . 0.0 113.07 -176.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.09 15.98 81.12 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 118.23 1.015 . . . . 0.0 113.678 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 59.4 t -131.6 140.07 49.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 119.326 1.563 . . . . 0.0 107.517 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.0 pt -62.46 146.12 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.975 -0.453 . . . . 0.0 110.522 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.55 -5.39 3.29 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.739 0.815 . . . . 0.0 112.392 172.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -153.57 154.55 34.47 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 169.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.2 m -140.1 24.46 2.34 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.654 1.182 . . . . 0.0 110.856 -171.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -140.15 122.61 9.96 Favored Pre-proline 0 C--O 1.234 0.251 0 C-N-CA 124.476 1.11 . . . . 0.0 108.201 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.92 -30.45 16.89 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.379 2.053 . . . . 0.0 111.819 -169.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.28 -41.24 73.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 121.473 -0.767 . . . . 0.0 109.11 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.97 -39.48 87.22 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.676 0.671 . . . . 0.0 109.905 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.96 -55.59 11.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.57 -39.19 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.37 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -60.36 -46.55 89.56 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.513 1.051 . . . . 0.0 110.743 176.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -72.68 -31.79 65.31 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.862 1.21 . . . . 0.0 111.754 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.92 -41.49 89.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 119.393 0.997 . . . . 0.0 109.432 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.38 -35.78 71.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.033 0.533 . . . . 0.0 111.85 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.32 -25.97 59.88 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.889 0.875 . . . . 0.0 112.397 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.295 171.327 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 . . . . . 0 C--O 1.235 0.335 0 CA-C-O 120.741 0.305 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 m -60.41 -34.28 73.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.505 1.122 . . . . 0.0 110.414 176.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.45 142.38 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -96.16 -41.7 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.412 1.085 . . . . 0.0 109.593 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.15 168.33 20.95 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.401 0.546 . . . . 0.0 111.642 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.9 137.08 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 127.292 2.237 . . . . 0.0 104.986 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 mt -133.89 151.26 51.45 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.473 ' CG2' HD11 ' A' ' 75' ' ' LEU . 62.6 mt -136.83 120.49 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 103.691 -2.707 . . . . 0.0 103.691 169.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.6 mt -123.68 148.84 46.14 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.733 0.813 . . . . 0.0 108.818 -169.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.68 172.25 3.6 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.685 0.755 . . . . 0.0 109.439 170.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.89 7.07 0.41 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.389 1.876 . . . . 0.0 114.054 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -131.66 11.0 4.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.873 1.669 . . . . 0.0 110.839 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.46 4.37 83.36 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.271 -0.893 . . . . 0.0 113.538 176.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -69.72 130.51 42.53 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.024 1.412 . . . . 0.0 110.197 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -67.14 105.5 1.71 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.397 1.079 . . . . 0.0 110.595 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.9 mt -81.55 -43.96 17.99 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 166.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -147.08 152.91 39.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.037 0.935 . . . . 0.0 109.741 174.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.11 149.98 19.88 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.045 0.938 . . . . 0.0 108.875 168.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -143.18 139.9 30.53 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 125.564 1.546 . . . . 0.0 106.941 169.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -127.27 150.11 49.71 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -129.29 -2.84 4.99 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -171.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -138.04 173.11 11.98 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.141 0.882 . . . . 0.0 110.921 -176.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -72.09 61.99 0.45 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.799 2.439 . . . . 0.0 109.044 174.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.6 m -154.31 91.99 1.47 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.638 -3.097 . . . . 0.0 102.638 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 55.43 60.9 8.91 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.377 1.471 . . . . 0.0 111.042 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -79.98 -2.73 12.3 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.5 2.133 . . . . 0.0 113.731 -175.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -136.22 141.88 44.01 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.379 0.99 . . . . 0.0 109.853 -169.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.2 t -43.92 -52.05 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 126.529 1.932 . . . . 0.0 113.326 -169.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -58.92 -42.72 90.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.527 0.603 . . . . 0.0 111.206 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.69 -32.39 63.91 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.678 0.391 . . . . 0.0 110.175 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -63.93 -48.83 74.98 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 123.232 0.613 . . . . 0.0 109.848 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -58.48 -35.74 72.66 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 118.754 0.706 . . . . 0.0 111.39 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.74 -48.74 70.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -63.3 -37.44 87.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.866 0.466 . . . . 0.0 111.189 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.7 -45.2 83.71 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.88 1.672 . . . . 0.0 111.004 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -60.8 -44.55 96.71 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.939 -0.475 . . . . 0.0 109.902 173.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.36 -46.51 79.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.251 0.62 . . . . 0.0 111.355 174.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.411 HD13 HD22 ' A' ' 62' ' ' LEU . 2.5 mm -57.59 -55.7 19.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 C-N-CA 124.468 1.107 . . . . 0.0 108.312 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -64.92 -41.04 95.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.982 0.356 . . . . 0.0 110.539 -175.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -59.42 -41.04 88.61 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.866 -0.521 . . . . 0.0 111.804 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -81.3 -45.71 15.8 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.22 0.463 . . . . 0.0 110.346 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.6 p -70.44 -26.89 63.86 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -169.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -74.2 -3.82 32.18 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.248 1.385 . . . . 0.0 112.091 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.3 mtt-85 -113.58 16.39 18.71 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 110.075 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -131.89 157.64 43.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.108 1.363 . . . . 0.0 108.599 -169.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.01 85.55 4.23 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.477 1.111 . . . . 0.0 109.67 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.5 m -47.07 136.85 8.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.051 1.74 . . . . 0.0 115.509 -169.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.06 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.454 1 C-N-CA 132.906 4.482 . . . . 0.0 107.433 173.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.29 156.82 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.561 1.544 . . . . 0.0 108.485 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.36 171.02 18.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.752 2.021 . . . . 0.0 108.721 174.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.8 tp -133.45 114.31 13.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.411 HD22 HD13 ' A' ' 48' ' ' ILE . 10.9 mp -114.24 98.82 7.17 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -174.129 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 57.72 14.33 2.39 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.224 1.81 . . . . 0.0 114.193 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.43 -31.2 2.9 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.683 1.611 . . . . 0.0 111.768 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.7 mt -83.28 129.94 35.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.433 1.116 . . . . 0.0 109.208 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -74.76 141.66 44.39 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 171.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 97.5 t -137.54 131.51 44.06 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.093 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.5 m -118.38 144.75 25.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 169.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -162.18 164.3 27.9 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 111.803 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -150.04 175.01 12.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.024 0.93 . . . . 0.0 108.594 169.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.3 p -139.61 145.35 38.43 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -145.69 137.9 25.52 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 11.8 mt 64.77 -82.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.21 1.804 . . . . 0.0 110.896 170.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -152.9 28.8 0.52 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.392 1.877 . . . . 0.0 108.934 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.473 HD11 ' CG2' ' A' ' 18' ' ' ILE . 47.6 tp -139.4 146.3 39.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 125.984 1.714 . . . . 0.0 109.428 -168.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -126.07 145.97 50.11 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.142 1.377 . . . . 0.0 107.482 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -136.21 138.07 41.5 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 -170.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -145.85 149.3 34.03 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.875 0.87 . . . . 0.0 111.359 -170.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.8 t -138.15 138.62 43.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 169.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.08 139.25 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -172.184 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -156.81 177.7 33.6 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-O 122.118 0.843 . . . . 0.0 112.594 -173.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.4 m -59.54 162.24 5.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.678 1.591 . . . . 0.0 112.452 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -71.84 27.46 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.698 1.999 . . . . 0.0 112.207 171.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -71.78 173.46 8.17 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.384 1.073 . . . . 0.0 112.142 -169.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.38 -7.59 38.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.74 1.616 . . . . 0.0 113.328 -172.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -141.8 159.87 41.33 Favored 'General case' 0 C--N 1.339 0.126 0 CA-C-N 119.061 0.846 . . . . 0.0 110.36 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.49 -6.57 10.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.322 2.249 . . . . 0.0 110.317 173.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -36.36 71.81 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.961 1.304 . . . . 0.0 111.099 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -65.86 -33.95 77.02 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.871 0.76 . . . . 0.0 111.675 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 34.3 mt -73.53 -42.48 61.69 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.0 mmt -56.64 -40.17 74.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.011 0.524 . . . . 0.0 110.06 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.89 -49.33 73.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.546 0.738 . . . . 0.0 109.887 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.0 t -60.14 -45.53 95.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 118.118 0.417 . . . . 0.0 110.166 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.5 tp -60.02 -49.29 78.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 122.903 0.481 . . . . 0.0 110.366 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.26 -42.02 96.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.846 -0.597 . . . . 0.0 110.594 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.2 m -60.11 -48.51 81.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.896 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 44.8 tp -64.86 -46.47 81.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.566 1.075 . . . . 0.0 111.155 -176.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.29 -46.88 88.31 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 122.999 0.52 . . . . 0.0 110.916 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.26 -26.4 52.45 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.33 -0.856 . . . . 0.0 111.641 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.7 m -62.98 -50.29 71.37 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.134 0.879 . . . . 0.0 110.313 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.2 mt -52.0 -47.75 64.79 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -58.92 -25.57 63.57 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.706 -1.14 . . . . 0.0 113.909 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -85.58 -53.5 5.13 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 121.041 1.746 . . . . 0.0 110.951 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -75.18 -38.11 60.98 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.598 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 tp -82.0 -39.1 24.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.959 0.504 . . . . 0.0 110.062 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.272 26.0 ptt-85 39.05 53.02 2.08 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.162 1.785 . . . . 0.0 112.237 -178.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -131.96 -169.82 2.28 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 128.215 2.606 . . . . 0.0 105.703 169.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -72.48 7.3 1.9 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.296 16.8 m 44.76 41.05 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.914 2.086 . . . . 0.0 112.164 -171.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -73.5 160.31 31.89 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.262 1.025 . . . . 0.0 109.485 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 33.4 pttt -60.37 -32.49 71.35 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -172.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -37.44 75.05 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.761 0.424 . . . . 0.0 110.258 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.74 -34.83 72.29 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.319 173.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -60.42 -45.38 93.82 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.962 -1.086 . . . . 0.0 110.441 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.79 -39.34 73.92 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.66 0.784 . . . . 0.0 111.094 175.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -63.66 -25.61 68.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.09 27.38 5.4 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 118.787 0.721 . . . . 0.0 112.689 -171.491 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -40.7 -48.82 3.02 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 125.074 1.349 . . . . 0.0 112.247 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.41 -40.29 96.8 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.819 0.736 . . . . 0.0 111.722 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.17 -44.33 97.87 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.79 -50.0 75.57 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.464 1.105 . . . . 0.0 110.322 175.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -54.91 -48.78 72.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.667 0.667 . . . . 0.0 109.897 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.91 -37.52 84.51 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.181 0.592 . . . . 0.0 111.194 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.81 90.38 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.655 0.661 . . . . 0.0 109.867 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.3 t -57.31 -44.38 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.564 0.62 . . . . 0.0 109.529 175.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -71.66 1.48 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.133 0.973 . . . . 0.0 113.433 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -118.28 -12.03 9.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.666 1.586 . . . . 0.0 111.34 172.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.6 mt -88.06 -40.57 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 24.0 t -133.69 145.61 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.319 1.048 . . . . 0.0 110.513 -169.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -144.87 130.7 19.16 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 125.846 1.658 . . . . 0.0 106.898 168.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.78 29.61 55.0 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 119.398 -0.668 . . . . 0.0 113.868 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.65 16.22 80.43 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.288 1.044 . . . . 0.0 113.289 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.5 t -127.91 138.45 54.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.9 pt -66.2 147.06 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.6 pp -128.03 -11.69 5.3 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.246 1.018 . . . . 0.0 111.692 177.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -147.79 157.22 43.43 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 169.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 7.3 m -141.83 26.64 1.88 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.996 0.918 . . . . 0.0 110.862 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -141.97 128.76 11.24 Favored Pre-proline 0 C--O 1.236 0.346 0 C-N-CA 124.084 0.953 . . . . 0.0 108.501 177.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.48 -38.55 8.24 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.846 2.364 . . . . 0.0 113.67 -172.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.281 0.0 OUTLIER -76.36 -26.98 56.25 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.873 -1.142 . . . . 0.0 110.162 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 -66.18 -44.33 84.32 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.537 1.062 . . . . 0.0 109.618 169.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.4 t -54.88 -51.64 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 118.926 0.785 . . . . 0.0 109.541 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.39 -38.22 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.05 0.841 . . . . 0.0 110.693 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -62.92 -38.85 92.62 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.674 1.125 . . . . 0.0 110.947 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 25.2 mtt-85 -64.01 -46.73 83.21 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.925 0.784 . . . . 0.0 109.998 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.7 t -58.34 -41.41 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.95 -33.95 74.54 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.553 0.741 . . . . 0.0 111.994 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 29.9 mt -72.34 -32.15 66.25 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.042 0.937 . . . . 0.0 111.983 177.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.332 -0.842 . . . . 0.0 109.998 176.647 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 C--O 1.235 0.294 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 m -63.15 -38.59 91.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.312 1.845 . . . . 0.0 110.637 175.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.7 m -141.66 153.39 19.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 124.644 1.178 . . . . 0.0 108.036 175.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -111.75 -28.7 7.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 117.206 -1.378 . . . . 0.0 110.688 174.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.14 166.66 25.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.14 1.336 . . . . 0.0 112.38 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.4 mt -136.21 136.67 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mt -135.41 154.02 51.6 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.048 0.939 . . . . 0.0 108.682 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.9 mt -138.83 123.87 21.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 169.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.5 mt -129.15 149.07 51.11 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -171.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -65.61 172.68 3.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.548 170.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -74.4 30.05 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.906 2.083 . . . . 0.0 111.878 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -147.98 7.66 0.83 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.278 2.231 . . . . 0.0 110.79 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.54 10.06 86.51 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 121.001 -1.062 . . . . 0.0 113.105 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -72.35 129.68 38.97 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 118.751 1.276 . . . . 0.0 109.949 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.74 106.84 0.73 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 125.315 1.446 . . . . 0.0 109.996 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.6 -44.41 8.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 166.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -147.29 151.5 36.72 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.754 0.822 . . . . 0.0 109.531 172.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.89 145.12 15.27 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 169.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -146.98 146.85 30.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.939 1.295 . . . . 0.0 108.181 174.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -135.23 149.64 49.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.259 1.424 . . . . 0.0 107.704 -174.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -132.62 0.34 3.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.674 1.19 . . . . 0.0 111.612 -174.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -131.9 160.63 35.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.845 0.858 . . . . 0.0 108.796 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.26 6.12 3.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.595 1.958 . . . . 0.0 112.897 -170.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 p -61.99 -48.63 79.47 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.823 1.249 . . . . 0.0 110.735 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -144.84 73.48 14.97 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.233 1.013 . . . . 0.0 109.212 -175.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -85.01 -2.51 9.59 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.459 2.106 . . . . 0.0 113.956 -173.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -137.65 140.73 41.01 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.368 0.985 . . . . 0.0 110.054 -169.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.23 -43.95 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.14 1.376 . . . . 0.0 113.229 -169.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -59.26 -38.29 79.71 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 117.799 0.272 . . . . 0.0 111.428 -176.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -85.84 -32.51 21.69 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.012 0.369 . . . . 0.0 110.236 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.6 -51.88 66.71 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 123.269 0.628 . . . . 0.0 110.201 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -60.41 -31.67 70.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.546 -0.721 . . . . 0.0 111.348 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.81 -48.13 67.13 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -61.51 -36.55 80.84 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.031 0.532 . . . . 0.0 111.055 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -66.83 -44.08 82.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.602 1.561 . . . . 0.0 111.311 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -60.71 -44.11 97.0 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.677 -0.639 . . . . 0.0 110.014 172.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.66 -45.95 81.37 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.599 0.76 . . . . 0.0 111.224 174.185 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.62 -53.35 45.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 C-N-CA 124.259 1.024 . . . . 0.0 108.474 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -62.5 -46.05 90.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.477 0.58 . . . . 0.0 110.362 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 -56.09 -42.45 76.76 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.997 0.919 . . . . 0.0 111.915 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -78.69 -47.83 16.17 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.171 0.589 . . . . 0.0 110.156 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.0 p -66.88 -30.38 70.52 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.54 -0.725 . . . . 0.0 111.851 -175.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -59.71 -20.72 58.24 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.363 -0.835 . . . . 0.0 112.23 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -108.58 17.63 21.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.842 1.657 . . . . 0.0 110.433 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 56.4 m -121.61 163.33 19.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.89 1.276 . . . . 0.0 108.942 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -95.63 25.5 4.52 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.076 1.75 . . . . 0.0 113.333 -169.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.0 m 73.82 176.88 0.24 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.315 1.846 . . . . 0.0 113.227 172.122 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.319 10.5 pt-20 56.33 -43.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 131.072 3.749 . . . . 0.0 116.354 -173.072 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -148.11 155.85 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 120.303 1.411 . . . . 0.0 109.766 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.85 167.03 27.74 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.248 2.219 . . . . 0.0 108.133 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 tp -135.08 116.07 14.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mp -117.35 97.29 5.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -172.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 57.45 15.92 2.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.225 1.81 . . . . 0.0 114.082 171.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.99 -28.36 3.91 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.7 1.619 . . . . 0.0 111.971 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.3 mt -82.26 128.27 34.02 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.474 1.137 . . . . 0.0 109.178 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.8 m -75.88 138.24 40.94 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 172.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.9 t -136.9 133.48 48.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.8 m -118.87 146.85 22.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 169.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -158.16 162.77 37.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.166 0.508 . . . . 0.0 110.981 -175.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -148.16 174.76 11.64 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.236 1.014 . . . . 0.0 108.418 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -139.76 146.58 39.69 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 169.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.1 m -142.45 137.66 30.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.89 0.876 . . . . 0.0 108.691 177.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.8 mt 63.17 -76.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 127.26 2.224 . . . . 0.0 110.805 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -156.37 31.35 0.33 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.719 1.608 . . . . 0.0 109.999 176.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.1 tp -140.17 149.46 43.0 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.293 1.437 . . . . 0.0 109.421 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -124.19 149.97 45.75 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.537 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -139.77 142.91 36.72 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.369 1.468 . . . . 0.0 107.862 -172.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -147.44 152.43 38.08 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.666 0.786 . . . . 0.0 111.189 -170.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.7 t -138.9 140.14 39.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 169.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.47 140.56 48.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.54 -179.86 34.64 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-O 122.664 1.147 . . . . 0.0 112.074 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.4 m -64.69 164.74 11.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.735 1.614 . . . . 0.0 112.557 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.2 p -74.02 37.93 0.1 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.997 2.119 . . . . 0.0 111.377 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -68.03 169.4 10.15 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.577 1.151 . . . . 0.0 110.819 -175.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.48 -4.18 21.51 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.651 1.18 . . . . 0.0 113.558 -174.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -149.35 172.63 14.6 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.368 1.467 . . . . 0.0 108.786 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.38 -1.98 3.51 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.055 2.542 . . . . 0.0 110.256 -176.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -64.49 -30.9 71.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.737 1.215 . . . . 0.0 110.51 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -35.06 79.28 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.263 0.938 . . . . 0.0 111.497 172.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -69.37 -46.41 67.02 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.1 mmt -55.25 -41.35 72.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.39 174.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.13 -50.08 71.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.005 0.922 . . . . 0.0 110.038 -179.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.33 -43.77 97.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.217 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.2 tp -60.89 -48.9 79.69 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 118.482 0.583 . . . . 0.0 110.486 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -63.67 -44.11 94.73 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.351 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 92.5 m -60.35 -47.06 87.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.147 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.6 tp -64.86 -49.12 71.78 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 119.057 0.844 . . . . 0.0 110.787 -177.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.59 -42.36 98.75 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.175 0.443 . . . . 0.0 110.927 -177.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -73.14 -36.63 66.71 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.49 -0.756 . . . . 0.0 111.173 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 20.8 m -63.76 -43.34 96.71 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.971 0.805 . . . . 0.0 110.85 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.8 mt -53.7 -50.35 66.07 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.9 m -57.18 -38.69 73.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.368 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.6 -49.54 66.0 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.35 -0.833 . . . . 0.0 111.54 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 4.2 ptp -69.99 -34.98 74.03 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.379 0.99 . . . . 0.0 111.211 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.43 -43.14 64.26 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.868 0.467 . . . . 0.0 111.024 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 51.96 27.21 4.2 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.065 1.346 . . . . 0.0 112.437 -169.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -156.59 -175.62 5.53 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.177 2.191 . . . . 0.0 107.676 177.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -46.85 123.45 5.18 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.992 1.317 . . . . 0.0 110.233 174.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 17.2 m -84.91 51.05 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.993 1.317 . . . . 0.0 108.974 171.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.11 178.21 7.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.364 1.066 . . . . 0.0 111.652 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -47.73 -54.28 12.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.65 1.18 . . . . 0.0 112.718 -175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -65.04 -41.37 95.28 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.313 0.506 . . . . 0.0 109.733 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.83 76.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.151 0.581 . . . . 0.0 111.97 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -69.54 -49.56 53.21 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 123.984 0.914 . . . . 0.0 110.253 171.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.6 tp -56.33 -37.41 69.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.808 0.843 . . . . 0.0 111.263 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -81.98 -3.31 54.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.543 0.737 . . . . 0.0 112.339 -178.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -132.91 22.43 4.19 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.786 1.235 . . . . 0.0 112.209 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -43.4 21.36 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.207 1.003 . . . . 0.0 111.724 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.26 -42.88 92.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.853 0.752 . . . . 0.0 111.466 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.14 -41.49 99.7 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 177.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.16 -48.92 78.79 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.559 1.144 . . . . 0.0 110.672 173.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.09 -45.52 83.29 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 118.808 0.731 . . . . 0.0 109.683 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.68 -35.38 78.73 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.164 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.25 89.7 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 119.081 0.855 . . . . 0.0 110.145 175.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.1 t -57.52 -47.74 84.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.11 -21.73 63.99 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.487 1.115 . . . . 0.0 113.158 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -97.64 -22.8 16.28 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.277 1.031 . . . . 0.0 111.562 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 67.4 mt -83.13 -45.29 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.3 0.954 . . . . 0.0 108.976 177.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 m -139.89 153.26 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.413 1.085 . . . . 0.0 110.684 -171.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -149.32 140.69 23.24 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.347 1.459 . . . . 0.0 107.85 169.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.45 28.01 54.84 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.464 -0.631 . . . . 0.0 113.463 177.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.68 17.79 79.57 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.194 0.997 . . . . 0.0 113.41 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 56.4 t -132.41 142.08 43.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 119.07 1.435 . . . . 0.0 107.383 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.6 pt -65.18 151.21 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 O-C-N 121.976 -0.452 . . . . 0.0 110.284 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 pp -134.32 -10.58 2.52 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.867 0.867 . . . . 0.0 111.939 170.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -149.01 155.61 41.04 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.3 m -140.31 23.56 2.35 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.241 1.417 . . . . 0.0 110.878 -170.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -140.46 125.1 10.91 Favored Pre-proline 0 C--O 1.236 0.356 0 C-N-CA 124.208 1.003 . . . . 0.0 108.865 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.88 -34.31 5.4 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.322 2.015 . . . . 0.0 113.924 -169.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.308 2.3 pp0? -76.11 -27.3 57.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.945 -1.097 . . . . 0.0 110.304 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -67.54 -45.29 76.1 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.357 0.98 . . . . 0.0 109.501 169.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.5 t -54.21 -56.52 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.58 -33.47 63.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.237 0.926 . . . . 0.0 110.656 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -50.31 74.24 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.334 0.97 . . . . 0.0 109.824 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -69.07 -30.92 69.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.996 1.271 . . . . 0.0 112.462 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.65 -43.92 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.661 1.119 . . . . 0.0 109.742 171.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.66 -31.08 66.43 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.095 0.558 . . . . 0.0 111.884 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.6 tp -68.76 -33.96 74.78 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 125.696 1.598 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 63.5 mtt85 . . . . . 0 C--O 1.249 1.052 0 O-C-N 123.383 0.427 . . . . 0.0 110.405 173.547 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.236 0.388 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 p -69.01 -37.52 78.73 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.4 m -139.82 157.56 26.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 174.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -121.94 -28.83 4.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.589 1.155 . . . . 0.0 111.058 -172.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -158.04 163.94 37.21 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.704 1.138 . . . . 0.0 110.689 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.8 mt -135.06 135.16 52.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.2 mt -133.91 149.31 51.29 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.92 116.72 14.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 103.592 -2.744 . . . . 0.0 103.592 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.8 mt -124.44 145.38 49.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.08 169.03 7.45 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.304 0.574 . . . . 0.0 110.305 169.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -13.77 1.93 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -178.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -112.99 5.9 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.649 1.18 . . . . 0.0 110.844 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.99 7.27 59.85 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 125.021 1.296 . . . . 0.0 112.666 173.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.44 131.69 45.16 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 119.252 1.526 . . . . 0.0 109.738 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -58.21 127.49 32.37 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.9 mt -107.84 -40.16 5.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 161.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -148.08 153.11 38.46 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 123.382 0.673 . . . . 0.0 109.713 170.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.5 145.9 19.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.208 1.003 . . . . 0.0 108.449 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -144.98 139.15 27.3 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.873 1.669 . . . . 0.0 106.77 176.913 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -128.63 151.02 49.96 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.928 1.291 . . . . 0.0 108.18 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -134.04 22.3 3.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.698 1.999 . . . . 0.0 108.4 174.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.72 147.98 48.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.652 1.581 . . . . 0.0 111.39 -168.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -96.73 -6.87 35.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.521 1.528 . . . . 0.0 111.953 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.5 m -70.68 -38.22 73.72 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.31 -0.869 . . . . 0.0 109.649 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -136.41 67.59 60.32 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 125.029 1.332 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -87.77 -1.33 7.34 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.768 2.312 . . . . 0.0 113.645 -176.371 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.8 m -135.23 141.0 45.71 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.065 0.848 . . . . 0.0 110.22 -169.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -46.03 -50.03 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.422 1.889 . . . . 0.0 112.736 -169.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -55.83 -47.29 77.46 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.144 0.429 . . . . 0.0 111.304 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -79.27 -32.42 43.67 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -177.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.34 -50.83 72.04 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 123.439 0.696 . . . . 0.0 110.624 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -62.7 -31.84 72.82 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.972 0.806 . . . . 0.0 111.132 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.95 72.15 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.914 -0.491 . . . . 0.0 110.007 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.91 -42.96 99.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.24 0.616 . . . . 0.0 110.223 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.14 -42.7 91.28 Favored 'General case' 0 C--N 1.334 -0.092 0 C-N-CA 126.562 1.945 . . . . 0.0 112.063 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -59.72 -43.32 94.22 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 118.996 0.816 . . . . 0.0 109.594 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -45.01 91.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 118.055 -0.974 . . . . 0.0 111.627 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.25 -55.55 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -58.61 -45.51 89.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.897 0.879 . . . . 0.0 110.702 -174.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -54.57 -45.52 73.54 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.267 1.027 . . . . 0.0 111.453 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 62' ' ' LEU . 15.7 mmmt -70.83 -49.58 44.82 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 119.065 -0.493 . . . . 0.0 110.348 -179.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 37.2 p -67.62 -31.3 71.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.54 1.064 . . . . 0.0 111.398 -173.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -59.27 -23.89 62.77 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.606 0.762 . . . . 0.0 111.304 172.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -120.71 36.06 4.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.315 1.446 . . . . 0.0 109.797 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.9 m -127.98 158.17 38.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.822 1.649 . . . . 0.0 106.581 170.016 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.75 -59.61 3.41 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.741 -0.6 . . . . 0.0 111.037 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m 177.57 -169.47 0.08 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.73 3.212 . . . . 0.0 107.286 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.322 10.4 pt-20 60.8 -47.91 0.11 Allowed 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 131.203 3.801 . . . . 0.0 117.196 169.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -158.41 152.72 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 121.024 1.738 . . . . 0.0 110.915 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.63 173.89 11.13 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.57 1.948 . . . . 0.0 108.775 170.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.3 tp -137.09 115.05 11.46 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.077 -2.194 . . . . 0.0 105.077 -176.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.406 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 1.5 mm? -75.62 -72.82 0.29 Allowed 'General case' 0 N--CA 1.457 -0.094 0 O-C-N 123.264 0.353 . . . . 0.0 110.138 -172.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -144.97 6.39 1.17 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.343 1.857 . . . . 0.0 110.881 -175.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 149.02 -40.27 0.9 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 126.086 1.803 . . . . 0.0 108.98 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.2 mt -68.61 142.93 55.0 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.9 m -107.86 146.44 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.9 p -139.67 118.77 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.3 m -86.41 150.05 3.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 106.282 -1.748 . . . . 0.0 106.282 169.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -153.73 166.09 33.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.582 0.706 . . . . 0.0 111.39 175.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.506 ' HE3' ' CE1' ' A' ' 98' ' ' PHE . 37.6 tttp -152.17 156.93 40.77 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.896 1.679 . . . . 0.0 106.758 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -136.13 135.53 39.33 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m -142.07 142.74 32.86 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.626 0.77 . . . . 0.0 109.382 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 mp 53.71 -85.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.156 2.182 . . . . 0.0 111.898 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -150.14 31.93 0.68 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.41 1.884 . . . . 0.0 108.806 -176.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.7 tp -140.38 145.21 36.81 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.494 1.918 . . . . 0.0 108.571 -169.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -127.79 140.25 52.16 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.679 1.192 . . . . 0.0 107.803 -179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -123.68 141.48 51.98 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.675 1.59 . . . . 0.0 107.47 -176.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -146.9 152.31 38.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 119.013 0.824 . . . . 0.0 110.524 -175.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 63.5 t -141.06 122.61 14.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 105.801 -1.925 . . . . 0.0 105.801 169.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -99.19 142.11 15.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.64 174.82 38.21 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-O 121.892 0.718 . . . . 0.0 112.4 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.31 176.5 3.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.148 1.379 . . . . 0.0 109.74 173.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.0 p -152.34 72.9 1.01 Allowed 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.377 -0.827 . . . . 0.0 109.383 172.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -54.94 -43.98 73.88 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.553 0.741 . . . . 0.0 111.037 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -145.17 -12.58 0.54 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.781 1.232 . . . . 0.0 112.173 172.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -156.52 175.69 13.7 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.565 1.146 . . . . 0.0 109.89 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.56 4.36 4.64 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.872 2.469 . . . . 0.0 110.585 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.2 -32.35 73.73 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 120.869 -1.144 . . . . 0.0 110.663 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -32.46 72.31 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.999 0.818 . . . . 0.0 111.682 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.89 -50.05 68.07 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 172.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.3 mmt -55.64 -41.24 73.28 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.538 0.335 . . . . 0.0 110.295 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.14 75.72 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.587 0.755 . . . . 0.0 110.287 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.91 -44.78 98.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 119.027 0.83 . . . . 0.0 110.07 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.82 -50.76 72.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.344 0.52 . . . . 0.0 110.616 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -64.24 -40.29 95.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 119.581 -0.247 . . . . 0.0 110.484 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.07 -45.56 93.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.474 0.71 . . . . 0.0 109.574 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 tp -65.08 -49.63 69.3 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.786 0.721 . . . . 0.0 111.114 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.506 ' CE1' ' HE3' ' A' ' 70' ' ' LYS . 68.5 t80 -60.93 -43.81 98.11 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.376 0.608 . . . . 0.0 110.88 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.59 -28.81 37.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.322 -0.861 . . . . 0.0 111.969 -174.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 23.3 p -66.72 -45.88 77.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 119.905 1.23 . . . . 0.0 110.01 172.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.1 mt -51.13 -49.43 60.81 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 m -58.85 -32.32 69.33 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.159 -0.924 . . . . 0.0 113.262 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -76.36 -50.64 13.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 120.603 1.547 . . . . 0.0 110.659 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -79.78 -32.21 40.88 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 119.357 -0.937 . . . . 0.0 112.95 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.503 HD21 ' HB1' ' A' ' 113' ' ' ALA . 18.3 tp -82.37 -32.54 29.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 118.058 0.39 . . . . 0.0 111.9 -170.513 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 46.36 47.79 13.69 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.083 1.353 . . . . 0.0 112.275 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -138.08 174.97 10.0 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.928 2.091 . . . . 0.0 105.903 169.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -72.25 15.32 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -178.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.28 24.0 m 44.06 41.7 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 127.148 2.179 . . . . 0.0 111.734 -173.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.6 170.57 15.51 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.205 1.002 . . . . 0.0 110.841 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -53.96 -42.09 68.52 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.476 0.71 . . . . 0.0 112.798 -176.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.7 tpp85 -66.57 -42.17 87.44 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-O 118.887 -0.578 . . . . 0.0 110.073 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.503 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -64.38 -39.03 93.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.899 0.772 . . . . 0.0 110.388 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.03 -50.97 71.6 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.614 0.766 . . . . 0.0 110.089 171.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.9 tp -58.0 -37.88 75.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.51 0.724 . . . . 0.0 111.684 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -67.61 -21.88 65.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.838 0.855 . . . . 0.0 112.864 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.43 24.6 4.8 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.259 0.936 . . . . 0.0 113.12 -171.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -45.33 3.44 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.197 1.399 . . . . 0.0 112.351 177.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -66.24 -38.2 87.33 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.427 1.012 . . . . 0.0 112.275 -178.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.84 -40.55 93.68 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 175.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.27 -48.91 77.67 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.139 0.976 . . . . 0.0 110.242 170.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -57.74 -46.56 84.29 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.9 mt -65.62 -38.88 90.68 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.472 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.97 -48.73 79.07 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-N 119.039 0.836 . . . . 0.0 109.631 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.0 t -56.72 -46.78 83.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.6 . . . . 0.0 109.458 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -68.71 -0.53 5.42 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.273 1.429 . . . . 0.0 113.56 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -120.64 -15.65 8.41 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.534 1.533 . . . . 0.0 111.34 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 65.7 mt -82.36 -37.04 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.306 1.043 . . . . 0.0 109.009 169.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.07 153.51 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.27 0.941 . . . . 0.0 110.384 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -150.54 136.94 18.76 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.307 1.443 . . . . 0.0 107.248 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.75 29.74 50.41 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.488 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.46 18.34 79.34 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-N 118.067 0.933 . . . . 0.0 113.7 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 41.4 t -126.47 133.03 69.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 174.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.5 pt -60.2 156.87 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.74 0.781 . . . . 0.0 111.422 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.0 mt -120.23 -22.24 6.66 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.291 1.836 . . . . 0.0 110.271 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -154.85 160.61 41.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.036 0.835 . . . . 0.0 109.973 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 m -135.52 14.04 3.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.998 1.319 . . . . 0.0 112.205 -169.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.79 123.29 10.61 Favored Pre-proline 0 N--CA 1.465 0.277 0 C-N-CA 123.72 0.808 . . . . 0.0 110.09 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.7 -44.63 13.12 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.728 2.286 . . . . 0.0 112.941 -170.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pp0? -73.92 -26.94 60.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 119.292 -0.963 . . . . 0.0 111.07 -175.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.05 -35.2 74.08 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.547 1.521 . . . . 0.0 110.539 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.7 -43.27 87.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 119.575 1.079 . . . . 0.0 109.24 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.43 -39.47 84.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.844 1.202 . . . . 0.0 111.028 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -61.04 -45.5 94.51 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.904 1.229 . . . . 0.0 110.155 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -59.04 -47.79 83.96 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.855 -0.528 . . . . 0.0 110.017 177.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 62.6 t -59.5 -41.93 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.496 0.718 . . . . 0.0 109.912 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.05 -34.86 77.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.186 0.595 . . . . 0.0 111.782 -178.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.33 -32.32 58.63 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.944 0.898 . . . . 0.0 111.929 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.838 178.834 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.234 0.253 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 m -54.06 -40.34 67.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.532 1.133 . . . . 0.0 111.267 -176.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.3 m -140.5 164.29 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.413 1.085 . . . . 0.0 108.692 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -122.8 -28.98 4.06 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 125.001 1.32 . . . . 0.0 110.191 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.75 166.9 27.9 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.753 1.16 . . . . 0.0 111.867 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -136.61 136.31 48.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -132.44 149.29 52.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 61.8 mt -139.1 120.39 15.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 104.175 -2.528 . . . . 0.0 104.175 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.8 mt -127.76 149.24 50.33 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.38 171.19 4.09 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -17.06 62.42 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.795 0.838 . . . . 0.0 112.354 173.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.5 -9.48 59.4 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.298 1.039 . . . . 0.0 112.095 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.44 86.01 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 0.0 112.274 -171.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -74.56 143.22 44.57 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.461 1.131 . . . . 0.0 109.941 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -59.61 133.02 55.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.626 0.648 . . . . 0.0 110.21 177.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt -106.31 -38.6 6.18 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 151.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.63 154.33 36.2 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.792 0.837 . . . . 0.0 110.632 172.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 146.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.433 1.093 . . . . 0.0 108.585 169.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.99 144.26 30.94 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 125.699 1.6 . . . . 0.0 107.505 171.212 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -128.81 150.47 50.3 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.554 1.542 . . . . 0.0 107.513 176.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -135.14 -0.86 2.7 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.816 0.846 . . . . 0.0 111.984 -174.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -135.02 160.2 39.07 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.885 0.766 . . . . 0.0 110.125 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -72.06 3.39 4.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.71 2.004 . . . . 0.0 113.194 -170.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -62.45 -49.04 77.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.414 1.085 . . . . 0.0 110.752 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -142.86 69.3 19.09 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.222 1.009 . . . . 0.0 109.537 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -85.74 -2.37 9.0 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.698 2.265 . . . . 0.0 113.627 -173.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.1 m -135.9 141.92 44.63 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 119.278 0.945 . . . . 0.0 109.617 -169.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.4 t -44.52 -52.82 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 126.469 1.908 . . . . 0.0 113.137 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -60.32 -45.0 94.96 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.624 0.647 . . . . 0.0 111.014 -175.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -69.98 -34.12 72.95 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -62.66 -51.5 67.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 118.625 -0.702 . . . . 0.0 109.857 174.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.97 -38.03 75.28 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.275 0.943 . . . . 0.0 111.496 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.17 -50.09 73.23 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.213 0.605 . . . . 0.0 109.609 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.52 -38.65 91.95 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.454 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.0 -45.09 96.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 126.444 1.898 . . . . 0.0 111.473 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.23 -40.03 93.52 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 121.546 -0.721 . . . . 0.0 110.035 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.476 HD21 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -57.03 -49.55 75.47 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.669 -0.681 . . . . 0.0 111.062 171.182 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -54.85 -50.71 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 124.703 1.201 . . . . 0.0 108.71 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -61.17 -49.32 77.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.67 0.388 . . . . 0.0 110.318 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -57.4 -49.37 76.41 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.893 0.477 . . . . 0.0 111.1 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm -60.46 -52.44 65.21 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.0 p -71.87 -32.16 67.19 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.903 -0.498 . . . . 0.0 111.885 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -63.12 -15.12 55.69 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.515 -0.74 . . . . 0.0 111.443 171.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -120.85 25.52 9.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.185 1.794 . . . . 0.0 109.837 -176.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 94.8 m -131.42 158.1 41.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.169 1.788 . . . . 0.0 107.711 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.18 -42.11 99.32 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 118.442 -0.79 . . . . 0.0 112.879 -170.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m 139.8 -177.71 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.805 1 C-N-CA 132.427 4.291 . . . . 0.0 108.878 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.324 10.2 pt-20 59.07 -44.03 0.07 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 131.226 3.81 . . . . 0.0 117.307 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.0 tt -150.23 155.48 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 120.61 1.55 . . . . 0.0 109.932 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.79 166.06 30.58 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.034 2.134 . . . . 0.0 108.541 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.66 115.71 14.96 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 104.331 -2.47 . . . . 0.0 104.331 171.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.476 HD13 HD21 ' A' ' 47' ' ' ASN . 1.5 pp -147.28 138.42 23.8 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.896 0.878 . . . . 0.0 109.565 -172.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 52.42 27.04 4.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.002 1.321 . . . . 0.0 112.196 -177.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.82 4.3 90.39 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.585 1.088 . . . . 0.0 113.525 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -108.74 138.85 44.39 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.453 1.501 . . . . 0.0 108.751 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 51.2 m -83.15 136.99 34.24 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 72.3 t -135.07 138.41 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 32.0 m -120.48 147.43 24.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -158.73 162.37 37.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.93 0.395 . . . . 0.0 110.958 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -149.71 175.83 11.23 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.457 1.103 . . . . 0.0 108.514 170.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.4 p -142.37 146.65 35.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 169.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -145.44 149.03 33.97 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.318 1.047 . . . . 0.0 109.115 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 mp 50.36 -90.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.151 1.781 . . . . 0.0 110.989 -172.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -148.55 36.71 0.81 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.411 1.884 . . . . 0.0 108.99 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 64.3 tp -134.14 145.21 49.06 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 127.24 2.216 . . . . 0.0 107.889 -169.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -125.02 144.98 50.12 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -133.96 141.21 47.2 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.126 1.37 . . . . 0.0 107.515 -173.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -145.46 147.52 32.28 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.958 0.903 . . . . 0.0 110.271 -171.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.0 t -134.77 137.32 51.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 105.329 -2.1 . . . . 0.0 105.329 169.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -127.98 133.86 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 105.117 -2.179 . . . . 0.0 105.117 -172.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -154.79 176.35 32.55 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 122.311 0.95 . . . . 0.0 112.695 -178.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.3 m -63.71 129.97 42.3 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 113.798 -1.201 . . . . 0.0 109.225 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -67.23 125.18 25.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -153.79 -175.57 5.43 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.003 0.921 . . . . 0.0 109.442 -169.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.8 -14.16 30.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.629 1.571 . . . . 0.0 112.789 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -144.47 159.24 43.08 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.264 1.026 . . . . 0.0 110.061 174.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.43 -4.16 7.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.056 2.542 . . . . 0.0 109.944 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.2 -31.73 71.49 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.941 1.296 . . . . 0.0 110.722 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.1 ptt? -64.92 -34.34 78.16 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.24 0.927 . . . . 0.0 111.664 173.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -70.11 -46.67 64.35 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.0 mmt -55.61 -40.58 72.29 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.281 174.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.13 74.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.066 0.946 . . . . 0.0 109.896 -178.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.5 t -61.94 -44.12 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-O 118.946 -0.55 . . . . 0.0 110.074 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.67 -46.89 87.8 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.907 0.776 . . . . 0.0 110.665 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -63.8 -45.17 90.88 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 119.04 -0.505 . . . . 0.0 110.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.9 m -60.45 -44.65 95.63 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.154 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.14 -55.72 29.1 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.615 0.643 . . . . 0.0 110.171 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -62.71 -43.95 97.47 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.899 0.38 . . . . 0.0 110.632 -173.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -71.7 -37.02 70.73 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.707 -0.621 . . . . 0.0 111.166 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 t -56.59 -52.38 65.06 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.159 0.984 . . . . 0.0 109.691 174.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 77.1 mt -53.77 -48.44 69.75 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.8 m -56.43 -35.58 68.0 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.613 -0.708 . . . . 0.0 112.332 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -74.59 -47.71 30.89 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.571 1.078 . . . . 0.0 111.233 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 10.2 ptp -69.35 -38.95 78.37 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -169.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.327 2.7 pp -97.26 -5.24 37.24 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -174.136 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 49.82 30.3 3.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -147.07 179.03 7.9 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.814 1.646 . . . . 0.0 106.879 169.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.87 137.1 57.88 Favored 'General case' 0 C--O 1.23 0.078 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.5 m -76.31 45.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.318 1.847 . . . . 0.0 111.604 -174.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.3 170.15 7.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.84 0.856 . . . . 0.0 111.16 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -54.79 -42.28 71.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.829 -0.545 . . . . 0.0 112.117 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -65.81 -42.49 90.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.485 0.584 . . . . 0.0 109.64 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.23 81.56 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.286 0.494 . . . . 0.0 110.355 -177.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.298 0.0 OUTLIER -74.84 -28.59 60.75 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.073 0.851 . . . . 0.0 111.587 -179.255 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.8 tp -60.89 -39.65 90.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.768 1.167 . . . . 0.0 110.774 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.26 -14.1 62.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.519 0.727 . . . . 0.0 112.179 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -127.75 24.9 6.06 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.267 1.027 . . . . 0.0 111.64 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.29 -45.76 24.43 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.405 1.082 . . . . 0.0 112.29 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.79 -43.53 96.06 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.05 0.841 . . . . 0.0 110.775 -178.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.48 -43.18 99.41 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.7 tp -56.47 -52.43 64.74 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.969 1.308 . . . . 0.0 109.993 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -59.11 -44.84 92.0 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.181 0.446 . . . . 0.0 109.879 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.09 -37.59 86.16 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.804 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.19 91.91 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.981 0.81 . . . . 0.0 110.463 175.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 48.6 t -54.68 -49.04 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -71.6 2.7 4.79 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.016 1.326 . . . . 0.0 113.631 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -119.09 -17.04 9.06 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.533 1.533 . . . . 0.0 111.305 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.33 -46.3 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.25 154.36 30.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.406 1.082 . . . . 0.0 110.8 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -147.3 137.86 23.43 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 125.926 1.69 . . . . 0.0 107.257 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.89 25.48 52.9 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.43 18.09 76.6 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-N 118.149 0.974 . . . . 0.0 113.363 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.6 t -131.8 139.47 50.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 119.343 1.572 . . . . 0.0 107.043 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 18.4 pt -64.07 150.08 10.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 O-C-N 122.147 -0.346 . . . . 0.0 110.667 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -132.79 -14.51 2.77 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.2 1.0 . . . . 0.0 111.928 174.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -149.54 154.07 38.16 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 169.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.4 m -137.12 26.66 2.94 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.561 1.144 . . . . 0.0 110.906 -169.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -143.07 125.74 8.9 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.42 -33.9 10.34 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.295 1.996 . . . . 0.0 111.643 -169.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.86 -40.36 79.38 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -178.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -68.27 -39.84 82.05 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.542 0.61 . . . . 0.0 109.795 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.9 t -55.58 -52.9 42.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 118.741 0.701 . . . . 0.0 109.47 173.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.59 -40.48 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.499 1.045 . . . . 0.0 110.11 -179.147 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -63.02 -40.21 97.08 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.032 0.833 . . . . 0.0 111.044 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -68.57 -42.32 78.48 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.506 -0.746 . . . . 0.0 110.281 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 53.2 t -57.51 -43.22 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 118.595 0.634 . . . . 0.0 109.409 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.1 -33.58 73.74 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.409 0.684 . . . . 0.0 111.914 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 31.3 mt -72.26 -31.3 65.65 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.197 0.999 . . . . 0.0 112.137 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.967 176.539 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 . . . . . 0 C--O 1.235 0.322 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 34.3 p -80.66 -44.02 19.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 p -122.27 121.57 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.745 1.218 . . . . 0.0 108.037 -169.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.465 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 68.0 mmtt -75.06 -42.16 57.51 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 123.655 0.782 . . . . 0.0 109.362 174.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.28 165.72 23.92 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.233 0.47 . . . . 0.0 111.196 -171.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.27 131.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.9 mt -130.41 148.16 52.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mt -138.54 118.84 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 173.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.7 mt -122.68 143.04 50.04 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -175.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.41 167.79 13.96 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 169.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -57.29 -22.03 38.94 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.67 -25.5 20.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.727 1.149 . . . . 0.0 111.305 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.81 6.97 5.79 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 126.046 1.784 . . . . 0.0 112.557 173.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.29 129.48 40.02 Favored 'General case' 0 C--N 1.338 0.075 0 CA-C-N 119.088 1.444 . . . . 0.0 109.789 -178.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -66.32 94.59 0.27 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 109.288 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -50.87 61.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 168.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -148.78 153.09 37.66 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -156.87 147.55 21.58 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 169.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.7 OUTLIER -143.51 147.89 35.17 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.077 1.351 . . . . 0.0 107.504 169.913 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -137.73 143.76 41.36 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.91 1.684 . . . . 0.0 106.482 -175.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.06 -2.99 5.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.262 1.025 . . . . 0.0 112.621 -173.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -131.04 162.71 29.21 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.842 0.746 . . . . 0.0 109.08 -177.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -71.72 7.27 1.56 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.833 2.053 . . . . 0.0 112.505 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 p -61.68 -52.7 63.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.46 1.504 . . . . 0.0 110.207 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -144.29 70.75 16.12 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 124.64 1.176 . . . . 0.0 109.039 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.02 -1.62 9.43 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 122.667 2.245 . . . . 0.0 113.69 -172.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 m -136.49 139.38 42.26 Favored 'General case' 0 C--N 1.34 0.174 0 C-N-CA 123.971 0.908 . . . . 0.0 109.773 -169.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.5 t -46.42 -49.1 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 126.066 1.746 . . . . 0.0 113.025 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -58.47 -43.31 88.85 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.722 0.692 . . . . 0.0 111.406 -176.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.14 -32.18 58.98 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.856 0.298 . . . . 0.0 110.299 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -62.48 -48.73 78.32 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.252 0.621 . . . . 0.0 110.231 175.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -59.79 -35.71 75.23 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.983 0.811 . . . . 0.0 111.178 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.05 -44.86 75.43 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.02 0.528 . . . . 0.0 109.961 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.77 -38.35 90.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.077 0.551 . . . . 0.0 111.005 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.75 -41.25 96.06 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.701 1.6 . . . . 0.0 110.872 177.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.3 mmtt -60.34 -45.9 91.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.708 -0.62 . . . . 0.0 109.769 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.2 -48.12 77.04 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.431 0.692 . . . . 0.0 111.176 174.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mm -56.68 -54.07 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 C-N-CA 124.41 1.084 . . . . 0.0 108.546 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -60.28 -48.99 79.37 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.174 0.59 . . . . 0.0 109.926 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -60.37 -39.66 88.02 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.517 1.127 . . . . 0.0 112.692 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt -73.37 -50.04 24.04 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 121.645 -0.659 . . . . 0.0 109.344 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.404 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 33.1 p -70.39 -31.87 69.28 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -69.11 -5.37 21.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.938 0.79 . . . . 0.0 112.527 173.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtp-105 -126.78 28.27 5.89 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.388 1.875 . . . . 0.0 109.353 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.495 HG21 ' HB2' ' A' ' 60' ' ' ALA . 99.4 m -134.47 158.17 44.59 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.913 1.685 . . . . 0.0 108.048 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 29.05 0.46 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.542 1.537 . . . . 0.0 113.324 -169.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m 67.81 -179.53 0.22 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.016 1.726 . . . . 0.0 113.319 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.7 pt-20 56.62 -43.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 131.362 3.865 . . . . 0.0 117.006 -176.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.6 tt -154.89 155.25 6.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 120.21 1.368 . . . . 0.0 109.772 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.495 ' HB2' HG21 ' A' ' 55' ' ' THR . . . -148.5 172.69 14.08 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.487 1.915 . . . . 0.0 108.389 172.087 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -134.43 121.24 20.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 103.64 -2.726 . . . . 0.0 103.64 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.2 mt -78.14 -69.08 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.062 -168.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -142.53 7.9 1.74 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.548 1.939 . . . . 0.0 110.281 -176.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.82 -43.73 0.78 Allowed Glycine 0 CA--C 1.525 0.662 0 C-N-CA 126.241 1.877 . . . . 0.0 108.703 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.6 mt -68.49 129.31 39.56 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.826 0.85 . . . . 0.0 109.889 174.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 85.3 m -78.76 148.13 33.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.4 p -140.13 130.9 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 171.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -101.3 144.8 12.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 25.7 p90 -160.11 162.16 33.97 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.004 0.366 . . . . 0.0 111.61 -175.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -154.46 -179.85 8.34 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 169.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -135.26 149.24 49.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 123.885 0.874 . . . . 0.0 109.094 170.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -146.44 142.2 27.9 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.3 mt 61.68 -84.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 126.703 2.001 . . . . 0.0 110.85 174.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -148.99 25.77 0.91 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.236 2.614 . . . . 0.0 109.737 -176.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.27 150.48 51.49 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.194 2.198 . . . . 0.0 109.581 -169.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -130.35 143.62 50.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.53 1.532 . . . . 0.0 107.582 170.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -135.89 137.42 41.41 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.801 1.24 . . . . 0.0 107.669 -170.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -144.08 144.6 31.69 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 -171.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 62.0 t -135.74 121.79 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.39 134.29 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 -173.144 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.465 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -149.42 172.39 29.44 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 122.005 0.781 . . . . 0.0 113.325 -174.314 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.5 m -64.72 164.16 12.65 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.466 -1.367 . . . . 0.0 109.277 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.9 m -129.01 29.12 5.24 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.915 0.886 . . . . 0.0 110.752 -169.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 38.8 p90 -61.69 -34.56 75.96 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.873 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -160.72 -33.31 0.05 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.484 0.584 . . . . 0.0 112.418 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.24 171.77 14.45 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.693 0.797 . . . . 0.0 111.487 -170.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.1 -2.5 2.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.888 2.475 . . . . 0.0 110.69 -174.262 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -66.16 -33.61 76.17 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 124.266 1.026 . . . . 0.0 110.714 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -32.49 74.08 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.643 0.656 . . . . 0.0 111.253 173.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.8 mt -70.25 -43.64 70.11 Favored 'General case' 0 C--O 1.23 0.067 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.8 mmt -55.82 -40.89 73.41 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.064 173.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -47.87 78.7 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.121 0.568 . . . . 0.0 110.468 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.25 -46.92 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.696 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 60.4 tp -60.07 -45.65 92.2 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.575 0.625 . . . . 0.0 110.514 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -63.24 -47.08 83.98 Favored 'General case' 0 C--N 1.338 0.094 0 CA-C-O 119.146 -0.455 . . . . 0.0 110.237 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.7 m -61.55 -44.66 96.63 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.192 0.451 . . . . 0.0 110.389 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.6 tp -60.5 -53.57 55.88 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.887 0.875 . . . . 0.0 110.791 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.82 -41.41 97.86 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.684 0.278 . . . . 0.0 110.908 -177.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -75.03 -31.81 61.42 Favored 'General case' 0 N--CA 1.456 -0.141 0 O-C-N 121.51 -0.744 . . . . 0.0 111.294 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -62.67 -47.75 82.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.916 0.78 . . . . 0.0 110.023 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.5 mt -51.7 -51.42 56.16 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -34.12 69.77 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -71.67 -41.55 68.56 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.645 1.111 . . . . 0.0 111.437 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -97.85 3.36 49.85 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -171.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.8 tp -141.32 58.19 1.52 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.208 1.803 . . . . 0.0 107.902 -172.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -69.54 49.83 0.09 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.49 2.316 . . . . 0.0 112.9 -171.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.7 pttt -137.55 -67.86 0.48 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.848 1.259 . . . . 0.0 109.318 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -159.45 149.19 18.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 174.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.5 m -90.91 50.42 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-O 121.809 0.814 . . . . 0.0 109.71 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.95 167.9 11.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.872 1.269 . . . . 0.0 111.275 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -49.15 -54.66 15.33 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.155 1.382 . . . . 0.0 112.743 -171.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -62.04 -42.64 99.4 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 122.462 0.305 . . . . 0.0 110.499 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.49 -38.58 87.56 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.388 0.54 . . . . 0.0 110.582 -177.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.79 -45.37 92.96 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 121.421 -0.799 . . . . 0.0 110.207 174.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 68.6 tp -57.28 -38.25 73.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.288 0.635 . . . . 0.0 111.322 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -71.5 -16.99 62.37 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.92 23.54 4.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.404 1.002 . . . . 0.0 112.685 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -37.41 -50.09 1.05 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.334 1.854 . . . . 0.0 113.179 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -62.12 -40.3 95.44 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.539 1.063 . . . . 0.0 111.377 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.76 -45.86 94.86 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 177.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.75 -51.08 71.48 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.021 0.928 . . . . 0.0 110.747 175.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -54.43 -48.39 71.73 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 109.6 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.78 -33.31 66.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.434 -175.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.84 -44.48 96.02 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 119.37 0.987 . . . . 0.0 109.843 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -58.04 -45.77 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.448 0.567 . . . . 0.0 109.482 175.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -3.02 6.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.687 1.195 . . . . 0.0 113.506 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -115.29 -17.97 11.19 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.222 1.409 . . . . 0.0 111.745 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 55.6 mt -86.1 -30.35 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.265 1.026 . . . . 0.0 109.179 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.6 t -139.97 147.59 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 125.245 1.418 . . . . 0.0 107.938 -170.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -143.31 130.84 21.16 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.86 1.264 . . . . 0.0 107.646 170.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.9 52.1 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.538 175.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.01 16.45 79.5 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-N 118.225 1.012 . . . . 0.0 113.684 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 57.4 t -127.87 142.32 44.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 44.2 pt -54.53 142.9 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.526 0.679 . . . . 0.0 110.562 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.53 -42.3 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.996 1.718 . . . . 0.0 108.317 -175.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -144.86 156.42 44.0 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.135 0.974 . . . . 0.0 108.716 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -135.29 24.92 3.51 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.152 1.381 . . . . 0.0 110.49 -172.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -141.84 118.1 7.18 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 124.377 1.071 . . . . 0.0 108.87 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 -32.57 11.59 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.701 2.267 . . . . 0.0 111.79 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.19 -40.44 86.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -69.63 -36.55 76.24 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.816 0.735 . . . . 0.0 110.298 177.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.7 t -56.78 -55.68 18.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 123.236 0.614 . . . . 0.0 109.396 175.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 34.1 m -67.18 -30.14 48.32 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 CA-C-N 119.2 0.909 . . . . 0.0 111.287 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.54 -51.88 67.56 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.017 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -62.53 -40.77 97.83 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.73 1.15 . . . . 0.0 110.844 178.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 t -56.66 -45.93 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.104 0.411 . . . . 0.0 110.384 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -79.62 -26.52 41.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.026 0.83 . . . . 0.0 111.452 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 63.7 tp -71.88 -22.29 61.53 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.396 1.879 . . . . 0.0 112.1 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.0 ptt-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.083 1.353 . . . . 0.0 113.167 178.632 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 . . . . . 0 C--O 1.237 0.436 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.7 p -66.85 -26.83 67.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 109.993 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -135.6 141.1 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -100.06 -27.34 13.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 117.682 -1.152 . . . . 0.0 109.723 173.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.27 166.09 28.19 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.56 1.073 . . . . 0.0 111.916 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.9 mt -134.01 137.19 52.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -134.11 150.79 51.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.405 HG22 HD11 ' A' ' 75' ' ' LEU . 61.0 mt -137.69 114.35 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 102.925 -2.991 . . . . 0.0 102.925 169.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 46.2 mt -117.29 147.78 42.27 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 122.238 1.018 . . . . 0.0 110.164 -169.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -68.85 172.55 6.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 113.449 -1.705 . . . . 0.0 107.928 169.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -78.08 35.6 0.21 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.05 2.14 . . . . 0.0 111.126 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -149.09 8.1 0.73 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.696 2.398 . . . . 0.0 110.838 178.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.11 47.91 69.29 Favored Glycine 0 C--N 1.342 0.872 0 O-C-N 120.883 -1.136 . . . . 0.0 110.767 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -123.97 126.7 46.77 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 118.013 0.906 . . . . 0.0 108.846 -178.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -60.61 107.98 0.76 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.78 0.832 . . . . 0.0 110.888 -177.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -74.12 -41.59 61.37 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 155.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -141.14 149.1 41.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.081 1.352 . . . . 0.0 108.208 171.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.55 144.02 16.55 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -148.23 147.63 29.59 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.013 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -135.49 149.11 49.44 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.624 1.57 . . . . 0.0 106.978 -176.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -133.54 -1.36 3.14 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.974 0.91 . . . . 0.0 111.92 -174.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -135.05 159.4 41.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.927 0.785 . . . . 0.0 110.036 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -73.53 2.28 8.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.021 2.129 . . . . 0.0 113.043 -169.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -59.64 -47.54 85.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.337 1.055 . . . . 0.0 110.724 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -144.87 79.38 12.11 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.53 1.132 . . . . 0.0 108.261 -177.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -92.67 -0.6 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.864 2.376 . . . . 0.0 113.504 -174.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 m -134.31 138.05 44.67 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.131 0.972 . . . . 0.0 109.814 -169.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.24 -44.85 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.257 1.423 . . . . 0.0 113.532 -169.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -61.14 -44.62 97.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 117.959 0.345 . . . . 0.0 110.646 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -78.9 -32.51 45.78 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.66 -50.1 73.86 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.355 0.525 . . . . 0.0 110.455 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -62.39 -33.46 74.8 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.064 -1.023 . . . . 0.0 111.153 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.5 73.69 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.946 -0.471 . . . . 0.0 109.866 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.17 -37.96 81.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.657 0.783 . . . . 0.0 110.699 175.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -63.33 -42.81 98.99 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.793 1.637 . . . . 0.0 110.997 176.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -61.36 -44.65 96.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.164 0.893 . . . . 0.0 110.447 172.142 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.15 -45.48 87.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.077 0.551 . . . . 0.0 111.198 177.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.1 mm -58.28 -53.91 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.377 1.071 . . . . 0.0 108.394 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.19 -43.74 95.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.73 0.412 . . . . 0.0 110.813 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -56.03 -48.24 76.33 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.347 0.659 . . . . 0.0 110.641 174.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -61.67 -50.66 71.6 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 118.107 0.412 . . . . 0.0 109.925 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.9 p -71.74 -31.16 66.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.925 0.784 . . . . 0.0 111.801 -171.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -62.88 -16.53 59.16 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.718 0.69 . . . . 0.0 111.467 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -117.95 25.0 10.66 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.093 1.757 . . . . 0.0 109.814 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.8 m -133.52 158.54 42.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.312 1.845 . . . . 0.0 107.554 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.97 -48.15 80.09 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 118.443 -0.789 . . . . 0.0 112.371 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.0 m 153.91 -175.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 131.768 4.027 . . . . 0.0 108.192 -177.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.2 pt-20 59.62 -43.4 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 131.486 3.914 . . . . 0.0 117.427 173.221 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.9 tt -155.3 153.01 8.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 120.729 1.604 . . . . 0.0 110.024 -176.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.06 172.24 14.57 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 126.038 1.735 . . . . 0.0 108.429 170.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.5 tp -140.8 116.18 10.05 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.7 mp -84.65 -155.85 0.22 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.447 1.499 . . . . 0.0 108.912 178.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.61 15.63 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.187 2.595 . . . . 0.0 114.205 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.55 -10.54 1.28 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 126.004 1.764 . . . . 0.0 112.1 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.2 mt -112.88 119.8 39.24 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.358 1.079 . . . . 0.0 109.319 -171.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.2 m -72.69 144.34 47.74 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 171.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 3.9 p -136.97 134.34 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.45 137.99 45.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -154.69 166.63 32.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 120.595 0.235 . . . . 0.0 111.027 -169.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -152.05 175.91 12.06 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 123.763 0.825 . . . . 0.0 108.913 169.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 m -141.15 133.4 28.07 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -144.46 145.75 32.07 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.48 0.712 . . . . 0.0 109.957 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.8 mp 49.31 -86.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.971 2.108 . . . . 0.0 111.614 -171.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -149.06 28.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.961 2.104 . . . . 0.0 108.978 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.405 HD11 HG22 ' A' ' 18' ' ' ILE . 57.5 tp -132.96 144.66 50.27 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.529 1.532 . . . . 0.0 109.198 -169.344 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -125.78 137.44 53.79 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -129.13 141.36 51.21 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.646 1.178 . . . . 0.0 108.214 -171.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -147.23 148.54 31.58 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.809 0.844 . . . . 0.0 110.866 -169.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.5 t -135.84 125.71 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 170.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.3 mp -114.78 137.67 47.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 -177.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.33 178.41 35.48 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-O 122.519 1.066 . . . . 0.0 113.294 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.9 m -65.27 133.84 52.33 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 112.972 -1.614 . . . . 0.0 107.798 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 m -78.56 48.17 0.77 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.836 1.254 . . . . 0.0 110.831 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -72.55 64.97 0.64 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.041 2.537 . . . . 0.0 110.617 -174.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 54.53 14.19 0.79 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.393 2.277 . . . . 0.0 113.754 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.76 160.67 25.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 126.833 2.053 . . . . 0.0 107.48 -171.21 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.98 -5.64 1.89 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.062 2.145 . . . . 0.0 110.047 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -61.25 -34.42 75.12 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.447 1.099 . . . . 0.0 110.671 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.38 -33.91 76.94 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.022 0.828 . . . . 0.0 112.054 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.5 mt -71.77 -41.91 67.82 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.1 mtp -60.29 -37.06 79.35 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.714 173.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.01 63.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.713 0.805 . . . . 0.0 109.851 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -61.56 -44.91 99.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 118.237 0.471 . . . . 0.0 109.869 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.89 -51.44 69.6 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 123.261 0.624 . . . . 0.0 109.744 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -62.16 -45.57 92.81 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.631 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 85.8 m -60.99 -42.81 99.14 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.083 0.856 . . . . 0.0 111.073 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.4 tp -68.56 -48.18 64.93 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.92 0.782 . . . . 0.0 110.794 -177.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -64.15 -40.29 95.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.941 -0.475 . . . . 0.0 110.824 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -77.21 -33.8 56.19 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.239 -0.913 . . . . 0.0 111.624 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.5 p -64.86 -42.26 95.01 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.729 1.15 . . . . 0.0 109.85 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.5 mt -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -61.13 -13.59 18.64 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -94.9 -37.75 11.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 120.611 1.55 . . . . 0.0 112.111 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -97.92 -0.95 43.95 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.0 tp -134.99 52.64 2.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.981 1.712 . . . . 0.0 109.206 -171.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -68.73 61.9 0.1 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.77 2.028 . . . . 0.0 112.627 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.428 ' HG3' ' H ' ' A' ' 108' ' ' ASN . 15.0 ptmt -138.29 -66.58 0.49 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.319 1.848 . . . . 0.0 106.952 169.443 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ASN . . . . . 0.428 ' H ' ' HG3' ' A' ' 107' ' ' LYS . 5.8 m-20 -163.6 150.04 11.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 129.102 2.961 . . . . 0.0 103.354 169.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.61 40.89 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 118.829 0.74 . . . . 0.0 109.962 171.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -86.2 172.74 10.29 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.242 1.017 . . . . 0.0 111.912 -173.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -54.81 -53.59 53.26 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 124.525 1.13 . . . . 0.0 112.51 -172.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.0 mmt180 -65.0 -39.23 93.15 Favored 'General case' 0 N--CA 1.463 0.202 0 O-C-N 121.979 -0.451 . . . . 0.0 110.19 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.53 -39.87 94.57 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.194 0.452 . . . . 0.0 111.228 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.303 0.0 OUTLIER -76.43 -29.78 57.14 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.98 -1.075 . . . . 0.0 110.864 178.39 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.6 tp -60.78 -36.14 78.25 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.726 0.694 . . . . 0.0 111.188 169.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -65.86 -25.72 67.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.679 -0.638 . . . . 0.0 112.711 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -131.01 31.9 4.39 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.823 0.849 . . . . 0.0 112.607 -173.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -39.18 -48.53 1.76 Allowed 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.816 1.646 . . . . 0.0 112.585 175.573 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -67.34 -35.45 79.4 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.676 0.671 . . . . 0.0 111.883 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.72 -42.53 99.76 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 172.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.75 -45.94 92.37 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.052 0.941 . . . . 0.0 111.23 173.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -54.99 -47.04 75.15 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.318 0.963 . . . . 0.0 109.788 175.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.3 mt -67.44 -32.8 73.91 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.673 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.59 -45.64 86.1 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.086 0.857 . . . . 0.0 110.151 174.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.33 -41.55 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 118.57 0.623 . . . . 0.0 109.924 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.91 -24.04 63.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.213 1.005 . . . . 0.0 112.574 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -91.85 -41.76 10.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.586 0.63 . . . . 0.0 110.927 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.65 -38.07 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 118.814 0.734 . . . . 0.0 109.481 -177.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.6 t -131.14 144.87 36.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.371 1.068 . . . . 0.0 109.21 -171.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -142.07 126.26 17.47 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 124.869 1.268 . . . . 0.0 107.687 169.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.92 30.29 59.97 Favored Glycine 0 CA--C 1.534 1.222 0 CA-C-O 119.361 -0.688 . . . . 0.0 113.35 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.32 12.21 84.79 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.335 1.067 . . . . 0.0 113.554 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.2 t -120.61 139.83 46.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 177.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.7 pt -56.4 138.82 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.196 0.522 . . . . 0.0 110.066 173.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -127.46 -35.62 2.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.581 1.553 . . . . 0.0 109.409 -171.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -138.93 151.64 47.07 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.5 m -139.24 29.25 2.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.776 1.231 . . . . 0.0 110.822 -169.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -137.98 121.69 11.57 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.31 -34.95 9.12 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.702 2.268 . . . . 0.0 113.634 -171.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -73.55 -38.35 65.27 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.162 0.892 . . . . 0.0 109.835 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -63.2 -37.23 86.41 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.167 0.894 . . . . 0.0 110.409 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.24 -53.52 38.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.686 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 26.3 m -66.5 -33.53 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 121.109 1.777 . . . . 0.0 112.263 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -61.6 -48.72 79.66 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.176 0.898 . . . . 0.0 109.554 177.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -70.21 -34.34 72.79 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.398 -0.814 . . . . 0.0 111.101 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 3.5 t -57.72 -45.77 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 121.394 -0.816 . . . . 0.0 109.633 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.05 -28.0 57.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 122.218 -0.301 . . . . 0.0 111.637 -175.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 54.3 mt -74.89 -26.57 59.75 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.286 1.034 . . . . 0.0 112.13 175.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 C--O 1.249 1.073 0 CA-C-N 119.14 0.882 . . . . 0.0 110.09 171.18 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -149.61 167.65 25.75 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.985 1.314 . . . . 0.0 108.56 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -156.51 163.15 39.74 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.868 1.667 . . . . 0.0 107.834 177.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.6 tp -61.56 -25.22 67.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.416 0.687 . . . . 0.0 112.025 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.8 mt -129.83 47.58 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 125.748 1.619 . . . . 0.0 106.68 178.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -58.29 -24.36 59.28 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.566 -0.708 . . . . 0.0 111.235 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -136.66 150.98 71.79 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 127.532 2.333 . . . . 0.0 105.787 169.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.89 55.67 4.49 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 125.216 3.944 . . . . 0.0 111.462 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 m -70.4 5.74 1.65 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.769 1.628 . . . . 0.0 113.311 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.8 pp -144.45 175.8 9.85 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 126.586 1.954 . . . . 0.0 109.101 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -130.12 143.71 50.94 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.444 1.097 . . . . 0.0 108.694 -173.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.4 p -67.29 -33.46 75.35 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.33 128.05 57.96 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 169.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.45 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 23.6 mtpp -86.5 -30.3 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 118.201 -0.904 . . . . 0.0 108.747 174.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.38 167.56 27.09 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 119.222 0.919 . . . . 0.0 111.564 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.2 mt -136.47 131.42 48.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.8 mt -131.82 148.55 52.56 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mt -140.58 120.28 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 173.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 mt -124.15 147.13 48.2 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.69 169.41 11.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 169.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.7 -18.82 56.5 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.18 -23.03 18.71 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.452 1.024 . . . . 0.0 110.865 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.75 7.45 6.13 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.652 1.596 . . . . 0.0 112.435 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -68.01 130.09 41.91 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 119.355 1.578 . . . . 0.0 109.891 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -67.58 94.49 0.42 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.719 1.207 . . . . 0.0 109.838 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.3 mt -71.32 -47.75 54.71 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -147.01 152.44 38.6 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.384 0.674 . . . . 0.0 109.378 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.22 147.04 19.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 169.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 1.0 OUTLIER -145.41 147.89 32.72 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 169.76 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -136.73 147.23 46.61 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.816 1.646 . . . . 0.0 106.756 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -133.73 8.3 3.85 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.662 1.185 . . . . 0.0 110.929 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -136.12 148.3 48.17 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.725 0.81 . . . . 0.0 111.298 -169.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.84 -9.01 49.01 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.893 1.677 . . . . 0.0 114.002 -172.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 p -62.86 -40.84 98.71 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.093 -1.004 . . . . 0.0 112.136 176.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -141.77 64.96 19.17 Favored Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 118.951 0.796 . . . . 0.0 110.863 -173.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -86.52 -1.32 8.32 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.817 2.345 . . . . 0.0 113.451 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.6 m -134.98 140.21 45.5 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.028 0.931 . . . . 0.0 109.676 -169.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -45.2 -51.06 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 126.353 1.861 . . . . 0.0 113.01 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -59.05 -43.81 91.74 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.481 0.582 . . . . 0.0 111.201 -175.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.45 -33.59 62.96 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -61.38 -48.91 79.08 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.499 0.72 . . . . 0.0 110.15 174.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.36 -35.81 74.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.207 0.912 . . . . 0.0 111.488 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.78 -48.61 73.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -63.45 -38.0 89.45 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.011 0.524 . . . . 0.0 111.123 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.01 -41.63 97.4 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.758 1.623 . . . . 0.0 111.258 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.03 -38.93 79.45 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 121.576 -0.702 . . . . 0.0 110.12 176.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.6 -51.07 68.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.908 -0.568 . . . . 0.0 110.343 169.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.1 mm -53.55 -55.06 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 124.987 1.315 . . . . 0.0 108.001 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -59.41 -48.05 83.13 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.789 0.436 . . . . 0.0 110.898 -175.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -58.65 -45.96 88.2 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.732 -0.605 . . . . 0.0 111.225 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -71.15 -6.1 36.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 117.596 -1.192 . . . . 0.0 113.167 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.7 p -125.11 -37.25 2.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 120.862 1.664 . . . . 0.0 113.479 -169.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -70.17 -0.35 7.67 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 120.321 1.419 . . . . 0.0 112.622 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -123.27 20.58 9.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.769 2.028 . . . . 0.0 110.009 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 98.3 m -138.26 160.06 40.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.083 1.353 . . . . 0.0 109.33 -169.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.21 85.51 4.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.537 1.135 . . . . 0.0 109.627 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.4 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 4.0 m -46.8 139.28 5.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.402 1.881 . . . . 0.0 115.779 -170.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 152.02 -37.49 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.321 1 C-N-CA 132.387 4.275 . . . . 0.0 107.521 170.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.31 155.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.462 1.105 . . . . 0.0 109.306 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.0 173.88 13.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.47 1.908 . . . . 0.0 108.324 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.0 tp -139.29 115.6 10.46 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.089 -2.189 . . . . 0.0 105.089 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.79 143.26 29.57 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.859 0.864 . . . . 0.0 109.848 -169.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 50.33 26.1 2.13 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.816 1.246 . . . . 0.0 112.721 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.68 9.98 82.18 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.054 1.312 . . . . 0.0 114.112 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.4 mt -123.81 130.88 53.32 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 126.093 1.757 . . . . 0.0 109.718 -172.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 m -74.49 142.19 44.85 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.88 132.61 34.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -101.61 149.84 6.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 33.5 p90 -154.67 163.83 39.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.575 0.702 . . . . 0.0 111.859 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -150.95 155.98 40.23 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.901 2.08 . . . . 0.0 106.184 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 m -140.06 143.94 36.59 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.4 m -145.16 128.58 16.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.795 0.838 . . . . 0.0 110.589 169.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.3 mt 57.59 -69.27 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 128.089 2.556 . . . . 0.0 114.783 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -146.09 19.84 1.41 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.208 2.203 . . . . 0.0 109.327 -171.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -138.73 147.01 42.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.471 1.508 . . . . 0.0 110.558 -168.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -132.97 141.35 48.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.694 1.598 . . . . 0.0 106.97 169.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -128.35 136.83 51.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.9 1.68 . . . . 0.0 107.038 -172.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -143.14 145.84 33.19 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.116 0.871 . . . . 0.0 110.478 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.8 t -136.74 127.88 41.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.72 136.15 59.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.45 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -157.87 -173.72 26.65 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 121.942 0.746 . . . . 0.0 112.394 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -67.84 171.22 6.85 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 113.824 -1.188 . . . . 0.0 110.041 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.3 m -130.21 28.52 4.99 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.465 1.106 . . . . 0.0 110.512 -171.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -59.24 -52.41 65.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.508 0.723 . . . . 0.0 112.324 -169.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -148.62 -12.87 0.34 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -153.28 164.96 37.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.788 1.176 . . . . 0.0 111.615 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.23 -3.58 5.61 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 127.699 2.4 . . . . 0.0 110.243 174.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.43 -32.96 74.8 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.37 1.068 . . . . 0.0 110.976 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.6 ptt? -64.05 -33.66 76.25 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.901 0.773 . . . . 0.0 111.638 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.7 mt -71.25 -45.99 62.0 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 10.1 mmt -54.67 -41.18 69.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.288 0.635 . . . . 0.0 110.433 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.43 -51.05 67.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 118.794 0.724 . . . . 0.0 110.129 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 53.3 t -62.29 -44.27 98.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 118.89 -0.576 . . . . 0.0 110.004 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 63.2 tp -62.09 -45.31 94.09 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.875 0.762 . . . . 0.0 110.781 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.5 t -59.51 -46.05 89.95 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.66 -51.52 66.9 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.604 1.161 . . . . 0.0 111.861 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -64.61 -40.82 96.18 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.183 -0.323 . . . . 0.0 110.65 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -75.15 -38.37 60.98 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.344 -0.848 . . . . 0.0 111.534 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 21.9 p -63.99 -41.33 97.54 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 119.352 0.978 . . . . 0.0 110.686 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.8 mt -53.88 -51.02 64.99 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 169.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.6 m -54.83 -36.53 65.1 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 118.633 -0.698 . . . . 0.0 112.008 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.466 ' HB2' HG21 ' A' ' 143' ' ' VAL . 48.4 mm-40 -72.5 -51.34 20.47 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.516 1.053 . . . . 0.0 111.634 176.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 58.5 mtm -69.16 -41.02 77.83 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.035 0.834 . . . . 0.0 110.298 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.8 mp -74.16 -31.41 62.69 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.775 0.83 . . . . 0.0 110.27 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 42.77 45.93 4.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.466 1.907 . . . . 0.0 111.258 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mmmt -145.9 -176.32 5.09 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 128.667 2.787 . . . . 0.0 106.868 -173.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.4 17.8 2.02 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.678 0.791 . . . . 0.0 111.396 -175.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.315 5.8 m 45.26 39.12 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 126.948 2.099 . . . . 0.0 111.949 -173.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -78.17 174.17 11.46 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.64 1.176 . . . . 0.0 110.897 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -50.66 67.73 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.066 0.946 . . . . 0.0 112.475 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -65.63 -38.71 90.17 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.199 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.84 -39.76 92.94 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.9 0.773 . . . . 0.0 110.624 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.26 -46.08 78.29 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.737 0.699 . . . . 0.0 111.047 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.9 tp -58.15 -38.64 76.99 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.966 0.507 . . . . 0.0 110.946 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -68.46 -16.97 64.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.251 1.02 . . . . 0.0 113.137 176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -132.52 22.51 4.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.295 0.952 . . . . 0.0 112.214 -169.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -45.0 -45.69 10.77 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.133 1.373 . . . . 0.0 111.905 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.34 -42.35 96.31 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.005 0.82 . . . . 0.0 111.371 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.33 -44.29 98.26 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.3 tp -57.46 -51.04 71.05 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.218 1.007 . . . . 0.0 110.709 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -56.21 -47.32 78.63 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.347 0.521 . . . . 0.0 109.773 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.8 mt -69.63 -30.78 68.58 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.043 -0.503 . . . . 0.0 111.781 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.92 -46.4 78.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.131 0.878 . . . . 0.0 109.706 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.6 t -57.87 -40.65 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.449 0.568 . . . . 0.0 109.77 176.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -63.0 -8.35 7.11 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.28 1.432 . . . . 0.0 113.905 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.27 -31.67 5.9 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.686 1.195 . . . . 0.0 111.723 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 72.6 mt -66.27 -41.08 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 109.085 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.5 m -140.38 160.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.327 1.051 . . . . 0.0 109.875 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -148.6 127.57 12.73 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.197 1.399 . . . . 0.0 107.671 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.16 31.53 56.35 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.34 -0.7 . . . . 0.0 113.434 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.6 11.21 85.5 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.2 1.0 . . . . 0.0 113.823 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -117.61 137.27 52.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 pt -55.14 138.03 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.321 0.581 . . . . 0.0 110.33 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -126.11 -39.97 2.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.41 1.484 . . . . 0.0 108.838 -172.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -145.26 150.82 37.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.57 0.623 . . . . 0.0 109.386 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.4 m -135.05 24.63 3.58 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.902 1.281 . . . . 0.0 111.144 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -128.71 118.77 19.97 Favored Pre-proline 0 C--O 1.236 0.375 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.19 -42.57 2.86 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 121.743 1.629 . . . . 0.0 112.255 -169.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.3 pp0? -70.51 -26.06 63.42 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.555 1.07 . . . . 0.0 110.776 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.41 -45.08 70.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.652 1.115 . . . . 0.0 109.975 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 16.6 t -52.6 -48.91 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.466 HG21 ' HB2' ' A' ' 103' ' ' GLN . 79.6 t -60.9 -41.53 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-O 118.201 -0.905 . . . . 0.0 111.014 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -57.62 -46.9 83.54 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.618 1.099 . . . . 0.0 109.448 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -65.14 -40.3 94.24 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.638 -0.664 . . . . 0.0 111.466 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 96.6 t -63.81 -43.55 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 118.811 0.732 . . . . 0.0 109.555 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.93 -35.74 80.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.02 0.528 . . . . 0.0 111.086 -178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.0 mt -76.66 -28.39 55.97 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.706 1.202 . . . . 0.0 112.519 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 . . . . . 0 C--O 1.25 1.086 0 CA-C-N 118.921 0.782 . . . . 0.0 110.187 172.365 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.07 -7.84 19.83 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.47 -9.39 59.45 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.091 0.957 . . . . 0.0 112.473 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.8 tp -141.29 -31.53 0.58 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.365 1.066 . . . . 0.0 111.861 -171.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.1 mt -127.55 52.04 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.9 tp -57.05 -34.03 67.83 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.42 169.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -136.05 152.83 76.22 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 126.632 1.973 . . . . 0.0 106.168 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.61 4.26 3.15 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.082 3.188 . . . . 0.0 113.264 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.3 m -58.96 -20.15 49.74 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.865 1.666 . . . . 0.0 113.205 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.7 tp -64.04 109.35 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 173.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -56.94 139.34 52.12 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.403 1.081 . . . . 0.0 109.989 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.6 p -71.78 -42.5 67.06 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 81.4 t -123.07 118.59 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -83.39 -33.99 25.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.13 175.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.89 167.27 24.97 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.412 1.005 . . . . 0.0 111.255 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -135.4 133.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 mt -132.98 146.77 52.07 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.557 ' CG2' HD11 ' A' ' 75' ' ' LEU . 54.2 mt -136.67 116.31 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 169.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.79 147.9 47.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.593 0.711 . . . . 0.0 110.486 -169.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -66.35 171.64 4.67 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.882 169.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 21.18 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.857 2.063 . . . . 0.0 114.111 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -136.45 11.48 3.23 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.469 1.908 . . . . 0.0 110.602 172.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.98 35.51 71.95 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 120.825 -1.172 . . . . 0.0 111.296 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -104.23 132.53 50.38 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.421 1.111 . . . . 0.0 109.29 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -58.87 114.88 2.76 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.834 0.854 . . . . 0.0 110.404 -174.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.5 mt -91.17 -42.66 10.32 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 156.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -145.47 149.03 33.92 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 169.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.12 144.25 12.8 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 168.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? -145.67 147.19 31.72 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.066 1.346 . . . . 0.0 107.689 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -132.19 150.44 52.15 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.834 1.654 . . . . 0.0 107.272 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -133.59 9.61 3.97 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.332 1.453 . . . . 0.0 110.597 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -129.2 150.18 50.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.283 1.433 . . . . 0.0 108.871 -169.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.16 -1.32 56.76 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.215 1.006 . . . . 0.0 112.98 -169.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 m -70.47 -34.32 72.26 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.683 0.674 . . . . 0.0 110.763 175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -140.56 67.23 30.05 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.058 0.943 . . . . 0.0 110.133 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -90.15 -2.71 5.42 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.705 2.27 . . . . 0.0 113.458 -174.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.4 m -135.45 145.75 47.52 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.003 0.921 . . . . 0.0 109.757 -169.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.5 t -45.54 -52.35 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 126.178 1.791 . . . . 0.0 113.036 -169.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.53 -45.5 88.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.755 0.707 . . . . 0.0 111.06 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.4 -35.06 65.8 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -177.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -61.12 -50.21 74.12 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.772 0.829 . . . . 0.0 110.047 174.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -60.14 -36.21 77.02 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.282 -0.886 . . . . 0.0 111.385 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.05 -47.64 76.63 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.09 0.556 . . . . 0.0 109.65 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -61.47 -37.66 84.43 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.432 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.2 -37.34 87.0 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.188 1.395 . . . . 0.0 112.042 176.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.92 -47.45 80.5 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.394 0.997 . . . . 0.0 109.236 172.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.31 -50.95 66.17 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.366 0.417 . . . . 0.0 110.551 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.5 -55.66 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 125.408 1.483 . . . . 0.0 108.415 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -66.8 -43.79 82.97 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 117.995 0.361 . . . . 0.0 110.782 -172.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.93 -50.39 70.86 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.59 0.356 . . . . 0.0 110.31 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.1 mmtm -66.16 -50.18 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 122.278 0.231 . . . . 0.0 110.531 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 38.4 p -70.82 -35.67 72.59 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -168.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.9 p-80 -71.08 -1.42 12.2 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 120.359 1.436 . . . . 0.0 112.266 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -122.72 23.16 9.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.57 1.948 . . . . 0.0 109.726 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.2 m -132.94 160.01 38.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.977 1.711 . . . . 0.0 108.268 -177.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -80.99 28.88 0.35 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.754 1.621 . . . . 0.0 113.282 -169.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.454 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 3.9 m 67.69 -177.62 0.21 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.168 1.787 . . . . 0.0 113.725 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 10.6 pt-20 57.91 -46.01 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 131.522 3.929 . . . . 0.0 117.078 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.4 tt -152.88 154.64 7.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 120.461 1.482 . . . . 0.0 109.785 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.11 174.08 13.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.65 1.58 . . . . 0.0 109.01 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.37 105.73 6.38 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 178.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.8 mt -127.84 132.56 49.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 52.98 26.58 4.83 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.655 1.182 . . . . 0.0 112.515 176.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 1.74 77.67 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.815 1.198 . . . . 0.0 113.945 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -112.22 142.8 44.26 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 119.381 1.59 . . . . 0.0 110.622 -177.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.9 m -75.12 141.07 43.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 171.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.68 134.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.18 147.3 15.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.193 -1.781 . . . . 0.0 106.193 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 32.5 p90 -156.68 158.57 37.21 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.969 0.414 . . . . 0.0 111.677 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -147.3 175.22 10.94 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.125 0.97 . . . . 0.0 108.383 169.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 p -145.15 149.06 34.31 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.0 m -147.69 147.42 29.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.326 1.05 . . . . 0.0 109.274 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 mp 49.53 -87.65 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 126.937 2.095 . . . . 0.0 112.109 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -145.26 26.0 1.35 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.849 2.06 . . . . 0.0 109.277 -176.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.557 HD11 ' CG2' ' A' ' 18' ' ' ILE . 62.3 tp -131.23 147.43 52.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.388 1.875 . . . . 0.0 109.347 -169.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -126.41 145.18 50.57 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.3 139.81 49.65 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.454 1.502 . . . . 0.0 107.422 -172.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -146.24 147.86 31.87 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.824 0.85 . . . . 0.0 111.029 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 93.5 t -135.68 127.82 46.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 169.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mm -114.63 135.83 53.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -171.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.19 173.64 32.01 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.84 1.244 . . . . 0.0 112.019 -172.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -68.96 167.92 14.8 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.13 -1.535 . . . . 0.0 111.139 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.0 m -61.14 -46.97 88.39 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 170.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 10.3 t80 50.23 -167.11 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.048 2.139 . . . . 0.0 112.084 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -83.83 -14.91 50.11 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.589 -0.694 . . . . 0.0 111.405 171.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -161.19 163.13 31.37 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 124.89 1.276 . . . . 0.0 110.398 -172.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.09 -6.39 10.91 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.858 2.463 . . . . 0.0 110.452 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.17 -32.76 72.5 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 124.947 1.299 . . . . 0.0 110.571 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -64.06 -33.33 75.5 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.847 0.749 . . . . 0.0 111.601 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.4 mt -72.64 -44.24 62.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.6 mmt -54.33 -42.01 69.71 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.374 172.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -48.49 77.43 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.542 0.737 . . . . 0.0 110.236 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.93 -44.67 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.018 0.527 . . . . 0.0 110.277 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 47.3 tp -60.39 -51.84 67.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 118.618 0.645 . . . . 0.0 110.035 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -71.55 -31.83 67.45 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 118.584 -0.722 . . . . 0.0 110.989 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.76 -49.63 76.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.082 0.855 . . . . 0.0 109.659 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.72 -46.12 89.57 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.739 0.699 . . . . 0.0 110.709 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.74 -43.57 98.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.013 0.525 . . . . 0.0 111.346 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.73 -36.61 67.8 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 121.432 -0.792 . . . . 0.0 110.886 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.7 m -63.62 -44.15 94.77 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.765 0.711 . . . . 0.0 110.927 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.5 mt -52.26 -53.62 41.56 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.0 m -55.84 -40.42 72.83 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.412 0.445 . . . . 0.0 111.565 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -67.64 -43.75 79.58 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.999 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 12.5 ptt? -83.37 -29.05 28.52 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.59 1.086 . . . . 0.0 112.312 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.409 HD21 ' HB1' ' A' ' 113' ' ' ALA . 17.3 tp -88.79 -33.48 17.42 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.2 0.6 . . . . 0.0 112.24 -169.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 49.96 33.09 6.24 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.936 1.694 . . . . 0.0 114.132 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -153.1 -174.93 5.11 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.909 1.684 . . . . 0.0 106.908 169.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -48.19 125.77 9.87 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 m -78.01 45.13 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.616 1.166 . . . . 0.0 109.322 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -80.4 163.85 23.53 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.751 0.82 . . . . 0.0 109.994 176.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -59.11 -36.52 75.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -169.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.0 tpp85 -65.4 -42.02 93.03 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.013 0.824 . . . . 0.0 110.138 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.409 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -67.58 -33.41 74.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.478 0.581 . . . . 0.0 110.787 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.5 -44.59 86.53 Favored 'General case' 0 N--CA 1.461 0.094 0 O-C-N 121.404 -0.81 . . . . 0.0 110.905 171.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.79 -38.38 72.43 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.435 0.694 . . . . 0.0 110.862 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.29 -21.99 65.66 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.24 27.27 5.37 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.466 1.03 . . . . 0.0 112.977 -175.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -40.88 -48.47 3.12 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 125.666 1.586 . . . . 0.0 112.922 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.7 -39.61 94.55 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.985 0.811 . . . . 0.0 111.304 -177.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.13 -43.56 92.99 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -58.22 -51.06 71.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.322 1.049 . . . . 0.0 110.298 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -56.29 -46.03 79.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.332 0.653 . . . . 0.0 109.961 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.85 -40.41 91.68 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-O 118.885 -0.579 . . . . 0.0 111.372 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.76 -46.45 90.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.93 0.786 . . . . 0.0 109.694 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.6 -46.47 86.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.302 0.501 . . . . 0.0 109.904 175.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.46 -21.83 66.53 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 112.936 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -92.01 -28.72 17.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.895 0.878 . . . . 0.0 110.656 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.1 mt -80.06 -37.46 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 118.967 0.803 . . . . 0.0 109.525 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 20.6 t -140.14 143.67 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.308 1.043 . . . . 0.0 108.923 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -145.69 134.55 22.45 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.584 1.154 . . . . 0.0 107.982 169.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.82 29.46 54.89 Favored Glycine 0 CA--C 1.533 1.156 0 CA-C-O 119.537 -0.591 . . . . 0.0 112.965 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.33 14.38 79.3 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 117.98 0.89 . . . . 0.0 113.949 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 26.6 t -120.04 135.54 60.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 24.1 pt -60.96 157.38 2.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-O 121.141 0.496 . . . . 0.0 110.411 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.5 mt -118.18 -48.48 2.53 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 124.272 1.029 . . . . 0.0 108.765 173.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -157.14 156.54 32.86 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.153 1.381 . . . . 0.0 107.563 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.4 p -140.44 17.26 2.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.986 0.914 . . . . 0.0 111.801 -174.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.66 114.96 63.09 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 169.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.38 -32.84 31.52 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.968 1.779 . . . . 0.0 113.025 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.15 -48.84 74.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.696 0.68 . . . . 0.0 109.183 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -66.22 -40.93 90.65 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.347 -0.846 . . . . 0.0 109.948 -175.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -56.75 -57.07 10.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 123.866 0.866 . . . . 0.0 109.509 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.23 -39.63 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.406 0.548 . . . . 0.0 110.466 -172.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -63.04 -44.05 96.97 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.637 0.653 . . . . 0.0 110.311 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -61.09 -46.24 91.45 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.672 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.68 -27.23 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 119.606 1.094 . . . . 0.0 111.881 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.53 -38.83 74.28 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.858 0.753 . . . . 0.0 111.281 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 49.1 mt -71.01 -38.54 72.63 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.827 0.851 . . . . 0.0 110.944 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.246 176.43 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.4 ttt . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -152.91 -172.2 4.17 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.905 0.882 . . . . 0.0 110.564 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 40.59 -92.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.732 2.813 . . . . 0.0 114.181 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.0 -31.6 65.26 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.218 1.007 . . . . 0.0 111.283 -177.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.5 mt -132.79 55.78 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 173.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -59.01 -32.41 69.69 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.714 0.806 . . . . 0.0 111.118 174.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -117.88 84.1 20.02 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 125.028 1.331 . . . . 0.0 108.717 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.49 12.51 0.85 Allowed 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 123.388 2.725 . . . . 0.0 112.396 172.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 m -57.85 -20.68 38.07 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.156 2.182 . . . . 0.0 113.831 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -65.7 -11.04 41.82 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.8 0.84 . . . . 0.0 113.152 172.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 74.94 123.87 0.04 OUTLIER 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.019 2.927 . . . . 0.0 109.314 -170.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.9 p -68.85 -36.01 77.62 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -135.52 142.8 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 169.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -98.76 -25.82 14.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 117.636 -1.174 . . . . 0.0 109.978 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.19 166.49 29.59 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.672 1.123 . . . . 0.0 112.059 174.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.95 133.06 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 104.654 -2.35 . . . . 0.0 104.654 172.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.6 mt -135.09 149.96 50.15 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.8 mt -138.91 124.22 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.532 -2.395 . . . . 0.0 104.532 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.9 mt -121.47 147.95 45.08 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -173.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.23 168.15 12.88 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.552 0.692 . . . . 0.0 109.727 169.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -55.11 -20.49 10.13 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.0 0.83 30.38 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.62 1.1 . . . . 0.0 111.494 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.06 17.44 43.56 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.953 1.263 . . . . 0.0 112.771 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.89 137.93 39.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.305 1.552 . . . . 0.0 109.878 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -60.33 120.62 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 175.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.2 mt -97.67 -44.53 6.73 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 163.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -145.23 151.3 38.18 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.123 173.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.51 144.69 15.6 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 169.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -147.51 148.97 31.76 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.77 1.228 . . . . 0.0 107.856 171.877 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -136.88 148.1 46.87 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.779 1.631 . . . . 0.0 106.925 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -133.89 2.55 3.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.973 0.909 . . . . 0.0 111.568 -174.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -132.9 159.2 40.59 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.011 0.925 . . . . 0.0 108.991 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.87 5.57 3.16 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.274 2.23 . . . . 0.0 112.51 -174.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -61.62 -48.16 82.15 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.938 1.295 . . . . 0.0 110.58 177.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -143.9 73.69 16.6 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.533 1.133 . . . . 0.0 108.542 -177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.41 -0.69 6.02 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.654 2.236 . . . . 0.0 113.521 -171.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 m -135.04 139.78 45.08 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.061 0.944 . . . . 0.0 109.459 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -43.58 -53.04 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.607 1.963 . . . . 0.0 113.043 -169.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -62.51 -43.54 98.55 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.387 0.539 . . . . 0.0 111.115 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -68.93 -35.66 77.05 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -63.78 -50.97 66.91 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.367 0.667 . . . . 0.0 110.558 176.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.62 -37.64 73.63 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.398 -0.814 . . . . 0.0 110.877 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.21 -45.56 80.34 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -61.99 -37.95 86.76 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.101 0.56 . . . . 0.0 110.897 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.99 -42.17 97.29 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.751 1.62 . . . . 0.0 111.181 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -66.01 -42.26 89.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.472 -0.768 . . . . 0.0 109.919 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.55 -46.77 77.07 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.068 0.547 . . . . 0.0 110.849 173.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.9 mm -56.5 -54.95 22.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 C-N-CA 124.673 1.189 . . . . 0.0 108.301 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -60.14 -48.8 80.22 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.188 0.449 . . . . 0.0 110.842 -177.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -58.91 -39.76 82.49 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.549 1.14 . . . . 0.0 112.126 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -76.92 -47.49 20.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.135 0.574 . . . . 0.0 109.956 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.9 p -70.53 -26.81 63.74 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.454 -0.779 . . . . 0.0 112.403 -169.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -73.87 5.35 4.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.077 1.308 . . . . 0.0 112.428 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.08 14.09 9.79 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.309 1.844 . . . . 0.0 110.723 175.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.6 m -120.69 162.93 18.85 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.379 1.072 . . . . 0.0 109.318 -171.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -88.59 23.11 2.36 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.371 1.468 . . . . 0.0 112.992 -169.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.4 m 68.64 179.79 0.23 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 0.0 113.848 175.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.31 10.5 pt-20 56.94 -50.95 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 131.275 3.83 . . . . 0.0 116.13 -175.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.0 tt -151.54 155.29 7.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 120.377 1.444 . . . . 0.0 110.062 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.28 164.83 35.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.405 1.882 . . . . 0.0 109.23 -177.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.09 106.92 8.94 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 102.442 -3.17 . . . . 0.0 102.442 170.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mp -81.01 -64.51 1.17 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -168.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -139.8 7.15 2.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.592 1.557 . . . . 0.0 110.844 -172.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 144.84 -38.82 1.25 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 126.04 1.781 . . . . 0.0 109.383 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -80.01 139.44 36.97 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.137 0.975 . . . . 0.0 110.463 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 62.1 m -85.22 141.19 30.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.931 1.292 . . . . 0.0 107.556 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 93.7 t -138.19 131.3 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 106.338 -1.726 . . . . 0.0 106.338 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.6 m -107.91 145.29 15.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 169.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -156.86 159.19 37.95 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.93 0.395 . . . . 0.0 111.721 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -150.4 171.02 17.68 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.369 1.067 . . . . 0.0 108.562 170.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -143.71 140.89 30.24 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 m -146.77 142.07 27.37 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.541 0.737 . . . . 0.0 109.581 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 53.79 -85.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 127.176 2.191 . . . . 0.0 112.328 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -146.6 29.57 1.02 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.269 1.827 . . . . 0.0 108.911 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.459 HD21 HD22 ' A' ' 114' ' ' LEU . 50.0 tp -137.43 147.24 45.23 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.257 1.823 . . . . 0.0 109.446 -169.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -129.55 139.26 51.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -127.19 140.48 52.21 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.624 1.57 . . . . 0.0 107.938 -172.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -146.31 149.17 33.31 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.161 0.984 . . . . 0.0 111.396 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 86.0 t -140.6 140.76 33.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -130.82 134.99 61.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 -171.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.17 172.1 37.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-O 121.942 0.745 . . . . 0.0 113.065 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.4 m -63.08 129.27 39.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.207 1.403 . . . . 0.0 109.999 -173.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -77.01 33.45 0.15 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.204 1.802 . . . . 0.0 113.48 -172.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.08 169.57 8.25 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.21 1.004 . . . . 0.0 109.166 169.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.43 26.62 0.05 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.115 1.766 . . . . 0.0 113.484 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -138.09 46.78 2.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 125.785 1.634 . . . . 0.0 109.124 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -55.84 -14.97 2.7 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.439 -0.788 . . . . 0.0 111.603 169.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -51.12 -35.63 36.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.587 1.955 . . . . 0.0 111.213 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.1 ptt? -71.5 -32.77 68.6 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.566 1.076 . . . . 0.0 111.614 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.43 -48.2 73.56 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.21 -41.67 79.87 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 122.485 0.314 . . . . 0.0 110.341 178.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.26 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.737 0.815 . . . . 0.0 110.319 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.3 t -61.99 -44.38 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.077 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.91 -49.62 76.74 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.724 0.693 . . . . 0.0 110.493 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -63.34 -41.61 98.88 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 119.559 -0.258 . . . . 0.0 110.482 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.2 t -60.92 -49.98 75.26 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.193 0.597 . . . . 0.0 109.621 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.14 -45.66 90.87 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -60.69 -47.92 84.09 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.58 -36.52 78.84 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.75 -0.594 . . . . 0.0 111.409 -177.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 61.2 m -59.04 -48.2 82.46 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.748 0.819 . . . . 0.0 110.631 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 36.2 mt -53.82 -50.71 65.57 Favored 'General case' 0 C--N 1.342 0.264 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 174.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.6 m -55.77 -37.91 69.18 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.677 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -70.81 -55.71 7.94 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.169 1.349 . . . . 0.0 110.141 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -74.25 -29.85 61.87 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.821 -170.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.415 HD21 ' HB1' ' A' ' 113' ' ' ALA . 16.2 tp -88.71 -34.72 17.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.107 0.563 . . . . 0.0 111.388 -174.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.289 0.0 OUTLIER 41.04 48.82 2.96 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.887 1.675 . . . . 0.0 112.684 -173.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -136.83 179.63 6.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.043 2.137 . . . . 0.0 106.402 169.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -70.53 14.67 0.12 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.278 25.3 m 44.49 40.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 127.122 2.169 . . . . 0.0 112.142 -173.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.15 165.72 24.51 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.391 0.677 . . . . 0.0 111.093 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -46.37 -51.61 14.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.429 1.892 . . . . 0.0 112.904 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -67.29 -41.38 85.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.139 0.427 . . . . 0.0 110.275 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.415 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -64.45 -34.96 79.42 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.646 -0.659 . . . . 0.0 110.523 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.459 HD22 HD21 ' A' ' 75' ' ' LEU . 3.5 mp -64.87 -46.97 79.56 Favored 'General case' 0 CA--C 1.521 -0.172 0 O-C-N 121.269 -0.894 . . . . 0.0 110.895 172.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.7 tp -55.2 -37.16 66.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.404 0.682 . . . . 0.0 111.081 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -70.37 -18.81 63.06 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.43 25.14 4.46 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.649 1.113 . . . . 0.0 113.014 -174.141 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -41.21 -47.35 3.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.467 1.507 . . . . 0.0 112.419 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.92 -39.43 94.16 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.037 0.835 . . . . 0.0 111.903 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.06 -43.75 98.34 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.2 tp -57.95 -49.37 77.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.977 0.911 . . . . 0.0 110.684 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -55.83 -47.63 76.89 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.483 0.583 . . . . 0.0 109.61 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.2 mt -67.57 -35.91 79.92 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.291 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.8 90.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.732 0.696 . . . . 0.0 109.85 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.6 t -57.44 -43.84 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 118.801 0.728 . . . . 0.0 109.648 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.07 3.82 3.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.139 0.976 . . . . 0.0 113.611 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -120.34 -27.13 5.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.605 1.562 . . . . 0.0 110.988 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.97 -39.7 77.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.255 0.934 . . . . 0.0 108.851 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.23 157.93 43.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.837 0.827 . . . . 0.0 110.738 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -145.62 130.1 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.951 1.7 . . . . 0.0 106.744 169.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.65 32.42 53.95 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.377 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.59 19.82 76.72 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.377 1.088 . . . . 0.0 113.662 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 72.4 t -124.64 139.56 50.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 174.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.18 135.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.346 0.593 . . . . 0.0 110.092 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -116.82 -42.24 2.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.714 1.606 . . . . 0.0 108.354 -173.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -147.86 152.1 37.05 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -131.5 -12.68 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.693 1.197 . . . . 0.0 111.428 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.76 117.04 62.07 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.337 0.971 . . . . 0.0 108.638 169.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.36 -31.68 27.66 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.24 1.96 . . . . 0.0 112.152 -172.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -44.38 85.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.614 -0.679 . . . . 0.0 109.319 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.89 -38.79 92.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.635 0.652 . . . . 0.0 110.544 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.6 t -56.71 -52.31 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 118.86 0.754 . . . . 0.0 109.366 173.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.9 t -63.14 -38.53 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.966 0.803 . . . . 0.0 110.499 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.2 -39.75 93.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.153 0.888 . . . . 0.0 110.822 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -64.34 -46.01 85.33 Favored 'General case' 0 CA--C 1.526 0.034 0 CA-C-N 118.723 0.692 . . . . 0.0 110.543 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.96 -40.69 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 118.904 0.774 . . . . 0.0 109.618 177.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.04 -33.74 72.35 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.569 0.748 . . . . 0.0 112.1 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 30.9 mt -72.64 -32.7 66.1 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.062 0.945 . . . . 0.0 111.936 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 . . . . . 0 C--O 1.25 1.088 0 CA-C-N 118.336 0.517 . . . . 0.0 109.898 178.08 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.1 ttm . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.2 mp0 -62.25 152.43 33.48 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.287 1.035 . . . . 0.0 110.219 178.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.53 -14.37 60.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -177.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -157.95 167.95 28.5 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 127.35 2.26 . . . . 0.0 107.598 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.59 128.04 23.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 173.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 75.3 mt -140.19 157.12 46.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 126.008 1.723 . . . . 0.0 107.059 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 28.54 63.72 0.7 Allowed Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 127.751 2.42 . . . . 0.0 113.112 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.5 166.7 24.8 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.704 2.936 . . . . 0.0 112.019 -173.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -122.43 26.39 8.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.268 1.427 . . . . 0.0 109.997 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tt -144.22 128.93 18.24 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 104.832 -2.285 . . . . 0.0 104.832 -177.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -57.12 133.95 55.45 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.807 0.843 . . . . 0.0 110.292 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.1 p -74.7 -34.81 62.7 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.9 t -132.03 139.98 49.01 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -106.85 -30.11 9.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.705 176.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.19 167.48 26.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.83 1.196 . . . . 0.0 111.847 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.5 mt -139.45 135.22 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 172.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.15 154.6 49.17 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.483 HG22 HD11 ' A' ' 75' ' ' LEU . 39.7 mt -139.61 120.42 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.669 -2.715 . . . . 0.0 103.669 169.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.12 143.57 48.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.613 0.765 . . . . 0.0 109.459 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -67.61 168.74 10.56 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 168.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -14.71 61.96 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.1 0.96 . . . . 0.0 112.244 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -74.63 -9.52 58.65 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.139 0.975 . . . . 0.0 112.207 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.24 52.89 9.8 Favored Glycine 0 C--N 1.341 0.849 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -172.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -136.92 131.44 33.07 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.633 1.173 . . . . 0.0 109.306 -173.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -59.66 107.23 0.57 Allowed 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.868 0.867 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 mt -73.83 -37.34 64.88 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 155.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -143.2 148.92 37.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.615 1.566 . . . . 0.0 107.851 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.89 141.89 10.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.4 OUTLIER -149.35 148.28 29.32 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.607 1.563 . . . . 0.0 107.714 176.903 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.43 152.24 46.9 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.711 1.604 . . . . 0.0 108.056 -173.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -136.12 -4.21 2.17 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.214 1.005 . . . . 0.0 112.581 -174.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -134.2 158.53 43.47 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.12 0.873 . . . . 0.0 110.037 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.4 2.05 6.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.144 2.177 . . . . 0.0 112.747 -172.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 p -59.71 -48.44 81.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.65 1.18 . . . . 0.0 110.431 174.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -145.16 75.61 13.85 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.5 1.12 . . . . 0.0 108.704 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -90.36 -0.99 5.38 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.714 2.276 . . . . 0.0 113.695 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -135.51 140.13 44.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 119.14 0.882 . . . . 0.0 109.943 -169.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.3 t -45.41 -50.4 3.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.532 1.933 . . . . 0.0 113.062 -169.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -57.9 -48.72 79.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.545 0.611 . . . . 0.0 110.927 -176.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.91 -35.13 72.15 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -63.29 -51.2 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.592 0.757 . . . . 0.0 110.924 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -62.01 -32.61 73.11 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.026 -1.046 . . . . 0.0 111.246 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.88 71.77 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.3 -38.96 88.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.998 0.919 . . . . 0.0 111.513 178.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -61.0 -48.96 79.4 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.046 1.738 . . . . 0.0 110.59 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -68.76 -35.43 77.07 Favored 'General case' 0 N--CA 1.463 0.175 0 O-C-N 121.75 -0.594 . . . . 0.0 110.903 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -47.83 76.9 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.536 0.734 . . . . 0.0 110.553 169.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.4 mt -61.56 -47.34 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.278 0.631 . . . . 0.0 109.703 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -60.42 -47.09 87.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.631 0.65 . . . . 0.0 109.961 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -54.58 -48.02 72.61 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.059 0.943 . . . . 0.0 111.524 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.8 mmmt -69.97 -49.36 52.47 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.306 0.642 . . . . 0.0 110.016 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 39.2 p -70.3 -27.46 64.41 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.638 -0.664 . . . . 0.0 111.818 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -62.14 -17.96 59.46 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.895 0.77 . . . . 0.0 111.943 170.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -117.59 25.04 10.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.313 1.845 . . . . 0.0 110.036 -175.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.8 m -132.55 158.22 42.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.841 1.656 . . . . 0.0 107.608 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.82 -41.8 98.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.1 m 141.89 -174.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 1 C-N-CA 132.531 4.332 . . . . 0.0 108.633 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.335 10.1 pt-20 61.08 -47.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 131.366 3.866 . . . . 0.0 116.859 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.61 152.54 10.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 120.198 1.363 . . . . 0.0 109.871 -175.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.79 165.18 31.33 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.404 1.882 . . . . 0.0 108.72 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -134.42 104.42 6.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 103.132 -2.914 . . . . 0.0 103.132 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -67.48 -63.09 1.13 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.358 -169.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -149.34 1.75 0.54 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.394 2.278 . . . . 0.0 110.308 -174.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.39 -35.95 1.21 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.03 1.776 . . . . 0.0 109.962 -171.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.0 mt -72.07 125.35 27.05 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 170.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 m -82.04 141.57 33.08 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.6 t -131.23 137.18 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.96 135.87 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -157.85 171.17 20.78 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.593 0.711 . . . . 0.0 112.072 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.9 tttp -153.94 157.08 38.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.026 1.73 . . . . 0.0 106.788 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -137.71 133.07 33.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -152.98 144.03 23.03 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.152 0.581 . . . . 0.0 110.401 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 mt 65.0 -84.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.403 1.881 . . . . 0.0 109.475 173.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -150.82 21.07 0.79 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.818 1.647 . . . . 0.0 109.52 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.483 HD11 HG22 ' A' ' 18' ' ' ILE . 21.9 tp -125.77 147.25 49.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 126.787 2.035 . . . . 0.0 110.144 -168.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -129.38 134.64 47.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -123.75 138.62 54.48 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.148 1.379 . . . . 0.0 107.501 -169.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -144.8 150.3 36.93 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.643 1.11 . . . . 0.0 112.099 -170.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.0 t -137.26 140.7 41.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 127.441 2.296 . . . . 0.0 104.953 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -131.14 135.87 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 -177.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.47 175.74 30.97 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-O 122.802 1.223 . . . . 0.0 112.502 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.9 m -61.21 154.17 24.16 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 112.599 -1.8 . . . . 0.0 110.639 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.4 m -57.01 -39.11 74.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.327 0.651 . . . . 0.0 109.881 171.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 5.9 t80 48.98 -143.59 0.48 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.689 1.996 . . . . 0.0 110.683 169.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.47 6.73 6.31 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.157 1.383 . . . . 0.0 111.625 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -159.19 163.19 36.21 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.489 1.516 . . . . 0.0 109.049 174.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -120.89 -6.87 9.56 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.436 2.294 . . . . 0.0 110.472 175.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.2 mt -57.17 -35.33 69.43 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 125.832 1.653 . . . . 0.0 110.655 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -65.06 -34.16 77.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.582 0.628 . . . . 0.0 111.912 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -73.51 -40.88 63.7 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.8 -45.57 70.8 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.982 . . . . 0.0 110.373 169.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.41 75.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.257 1.023 . . . . 0.0 110.387 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.5 t -61.34 -44.56 98.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 C-N-CA 123.3 0.64 . . . . 0.0 110.006 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.4 tp -60.15 -48.99 79.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.2 0.455 . . . . 0.0 110.274 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -61.37 -44.82 96.51 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 119.47 -0.3 . . . . 0.0 110.4 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 94.6 m -62.5 -45.53 92.57 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 118.885 -0.579 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.6 tp -65.95 -46.19 79.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.195 0.907 . . . . 0.0 110.819 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -64.16 -41.99 96.92 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 117.981 0.355 . . . . 0.0 110.799 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.76 -39.55 84.14 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.571 -0.705 . . . . 0.0 110.801 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.1 m -59.8 -48.05 83.25 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.323 0.649 . . . . 0.0 110.734 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -52.88 -48.86 66.83 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -60.24 -27.13 66.96 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.355 -0.831 . . . . 0.0 113.028 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.5 mm-40 -81.9 -53.33 6.25 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 120.12 1.327 . . . . 0.0 110.771 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -78.75 -33.79 46.27 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -168.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.56 -43.87 68.58 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.304 0.956 . . . . 0.0 109.104 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? 49.61 51.53 16.28 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.817 1.247 . . . . 0.0 110.048 -169.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -137.49 -171.37 2.96 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.762 2.425 . . . . 0.0 106.875 176.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -77.38 5.84 8.0 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.273 0.629 . . . . 0.0 112.113 175.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.324 4.8 m 49.2 40.34 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 126.91 2.084 . . . . 0.0 112.204 -174.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.27 168.83 18.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.128 0.971 . . . . 0.0 110.205 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -49.16 -48.23 45.1 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.605 1.162 . . . . 0.0 112.591 -176.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -66.4 -39.95 89.33 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 118.644 -0.694 . . . . 0.0 110.341 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.34 -36.88 85.17 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.201 0.91 . . . . 0.0 110.487 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.99 -47.06 78.89 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.769 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.3 tp -56.67 -38.06 71.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.69 0.677 . . . . 0.0 111.331 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.62 -19.08 64.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.03 0.932 . . . . 0.0 112.887 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -131.75 24.77 4.69 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.105 0.962 . . . . 0.0 111.561 -169.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -47.88 -47.66 31.7 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.917 1.287 . . . . 0.0 111.472 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -66.93 -36.34 82.02 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.241 0.473 . . . . 0.0 111.416 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.44 96.51 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.1 -49.07 79.09 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.685 1.194 . . . . 0.0 111.096 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -54.11 -48.42 70.76 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.983 0.811 . . . . 0.0 110.362 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 71.9 mt -68.43 -34.85 76.73 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.097 -0.478 . . . . 0.0 111.526 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.9 -44.94 83.79 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.925 0.784 . . . . 0.0 109.867 175.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.6 t -56.61 -45.29 82.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.8 -5.92 10.37 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.867 1.267 . . . . 0.0 113.686 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -112.3 -18.39 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 111.774 174.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 80.9 mt -81.4 -41.64 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.487 1.04 . . . . 0.0 108.467 172.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.9 p -145.0 148.11 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.267 1.027 . . . . 0.0 109.003 -169.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -146.89 136.44 22.93 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.8 29.58 50.41 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.928 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.68 14.86 81.69 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 118.171 0.986 . . . . 0.0 113.627 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.72 125.99 73.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.1 pt -57.93 145.72 8.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.3 pp -133.99 -13.33 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.022 0.929 . . . . 0.0 111.875 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -149.14 157.41 43.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.136 0.88 . . . . 0.0 108.964 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.7 p -143.93 31.06 1.28 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.809 1.643 . . . . 0.0 109.96 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -134.63 114.04 12.09 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 125.08 1.352 . . . . 0.0 107.897 178.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.82 -31.49 10.22 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.308 2.005 . . . . 0.0 112.16 -170.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -66.64 -45.38 79.21 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -71.98 -30.55 65.37 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.214 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.6 t -57.07 -54.62 27.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.612 1.096 . . . . 0.0 108.451 169.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.18 -36.18 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 119.159 0.89 . . . . 0.0 111.275 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -55.77 -49.82 72.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.134 0.879 . . . . 0.0 109.989 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -63.01 -40.66 98.44 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.407 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 69.3 t -59.37 -43.54 90.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.778 1.172 . . . . 0.0 109.935 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.7 75.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.307 0.643 . . . . 0.0 111.674 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.23 -37.39 80.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 125.966 1.706 . . . . 0.0 111.622 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 . . . . . 0 C--O 1.249 1.047 0 C-N-CA 123.999 0.919 . . . . 0.0 109.817 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.1 ttm . . . . . 0 N--CA 1.484 1.229 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -152.26 163.31 39.69 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.072 1.349 . . . . 0.0 108.518 178.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.82 -1.49 1.26 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.331 1.053 . . . . 0.0 112.502 176.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.3 mt -148.18 164.65 33.29 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.932 2.093 . . . . 0.0 106.823 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.11 114.78 1.83 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 169.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -74.06 -19.93 60.45 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.18 0.592 . . . . 0.0 112.351 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -131.08 76.12 77.18 Favored Pre-proline 0 CA--C 1.539 0.523 0 C-N-CA 124.872 1.269 . . . . 0.0 107.771 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.74 -29.36 19.29 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.644 2.229 . . . . 0.0 111.98 -176.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.7 m 53.27 20.85 2.04 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.474 1.91 . . . . 0.0 114.539 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.92 172.38 16.87 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.287 1.835 . . . . 0.0 107.848 169.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -59.4 122.01 12.88 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 176.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 36.1 p -72.35 -31.65 65.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 173.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 m -136.44 139.81 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 123.64 0.776 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -91.94 -36.01 13.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.183 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.27 167.25 24.24 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.239 0.927 . . . . 0.0 112.541 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.7 mt -135.32 135.7 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 104.789 -2.301 . . . . 0.0 104.789 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 mt -133.92 151.93 51.67 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.5 mt -139.72 120.21 14.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 169.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 mt -123.76 144.5 49.65 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -172.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 168.41 9.61 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.401 170.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -71.68 10.46 0.66 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.665 1.186 . . . . 0.0 113.881 -174.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.99 5.17 5.94 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.64 1.576 . . . . 0.0 110.621 169.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 6.02 58.25 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 125.286 1.422 . . . . 0.0 113.203 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -69.83 132.42 46.01 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.426 1.613 . . . . 0.0 109.865 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -60.21 123.75 18.18 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.3 mt -100.11 -41.27 7.2 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 162.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -147.86 152.12 37.08 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.431 0.692 . . . . 0.0 109.6 172.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.08 146.63 18.99 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 169.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -146.39 145.19 30.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 172.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -134.67 148.65 50.39 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 125.621 1.569 . . . . 0.0 106.855 -177.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -130.41 7.14 4.9 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.267 1.027 . . . . 0.0 110.684 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -133.66 147.38 51.42 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.081 0.952 . . . . 0.0 110.674 -170.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.61 -7.51 33.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.163 1.785 . . . . 0.0 114.483 -169.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.9 p -67.04 -35.29 79.57 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.646 1.112 . . . . 0.0 112.618 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -141.36 63.51 17.7 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 119.323 0.965 . . . . 0.0 111.231 -174.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -86.69 -1.39 8.21 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.98 2.454 . . . . 0.0 113.314 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.2 m -134.73 140.49 45.99 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.086 0.955 . . . . 0.0 109.511 -169.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.2 t -44.52 -52.63 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 126.338 1.855 . . . . 0.0 112.955 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.87 -43.24 98.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.683 0.674 . . . . 0.0 111.193 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.57 -33.97 64.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.4 -50.01 75.28 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-O 118.691 -0.671 . . . . 0.0 109.726 172.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -57.52 -37.2 72.64 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.176 0.898 . . . . 0.0 111.405 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.25 -50.13 72.96 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.313 0.645 . . . . 0.0 109.508 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.4 -37.48 87.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.847 0.459 . . . . 0.0 111.578 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.48 -45.74 91.64 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.131 1.772 . . . . 0.0 110.537 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.87 -42.94 97.39 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.903 -0.498 . . . . 0.0 109.993 175.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.0 -49.96 70.2 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.214 0.606 . . . . 0.0 110.888 173.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -58.05 -51.77 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.061 0 C-N-CA 123.974 0.91 . . . . 0.0 108.766 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -60.64 -47.91 84.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.371 0.532 . . . . 0.0 110.702 -174.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -56.65 -50.6 71.57 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 122.889 0.476 . . . . 0.0 110.855 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -64.83 -46.75 80.65 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.3 p -71.03 -32.62 69.42 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.669 -0.644 . . . . 0.0 111.822 -174.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -62.72 -12.73 25.71 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.368 -0.833 . . . . 0.0 111.701 170.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -122.34 25.02 9.12 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.063 1.745 . . . . 0.0 109.754 -175.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 99.2 m -133.06 161.64 33.84 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.834 1.653 . . . . 0.0 108.505 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -87.47 25.34 1.45 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.441 1.496 . . . . 0.0 113.426 -169.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.478 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 7.2 m 69.05 178.92 0.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.79 1.636 . . . . 0.0 113.728 176.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.6 pt-20 55.96 -46.56 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 131.107 3.763 . . . . 0.0 116.706 -174.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.8 tt -149.78 156.81 6.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 120.278 1.399 . . . . 0.0 109.62 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.87 158.29 43.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.479 1.912 . . . . 0.0 108.392 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -121.89 99.24 6.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 101.754 -3.424 . . . . 0.0 101.754 169.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.41 -62.3 1.61 Allowed 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 123.64 0.776 . . . . 0.0 112.217 -168.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -149.44 4.96 0.61 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.582 1.953 . . . . 0.0 110.783 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 142.75 -35.39 1.71 Allowed Glycine 0 CA--C 1.528 0.852 0 C-N-CA 126.353 1.93 . . . . 0.0 108.817 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.35 133.51 47.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.322 1.049 . . . . 0.0 108.418 169.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.3 m -90.2 144.11 26.16 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.6 t -136.54 137.89 47.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.3 m -119.92 146.18 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.478 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 25.7 p90 -157.74 160.27 37.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.091 0.472 . . . . 0.0 110.848 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -148.16 174.59 11.81 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.137 0.975 . . . . 0.0 108.63 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.7 p -140.57 145.46 36.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 171.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -146.79 142.29 27.58 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.69 0.796 . . . . 0.0 109.341 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.6 mp 53.03 -84.29 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.155 2.182 . . . . 0.0 111.454 -174.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -149.85 30.76 0.72 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.415 1.886 . . . . 0.0 109.06 -176.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.6 tp -137.83 148.18 45.22 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.203 1.401 . . . . 0.0 109.774 -169.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -124.9 146.55 49.27 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.926 0.891 . . . . 0.0 108.95 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -135.69 142.97 45.17 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.41 1.484 . . . . 0.0 107.96 -171.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -147.53 151.07 35.7 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.023 0.929 . . . . 0.0 111.258 -170.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -139.8 141.16 34.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 169.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.91 135.49 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 -173.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -167.71 -176.75 38.61 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-O 121.984 0.769 . . . . 0.0 113.532 -178.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.9 m -62.41 161.19 12.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.703 1.601 . . . . 0.0 111.605 -176.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.8 p -126.37 13.67 7.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.007 1.323 . . . . 0.0 111.966 -170.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 2.1 p90 -54.79 -50.4 68.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.772 1.629 . . . . 0.0 113.416 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -147.33 -23.3 0.39 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -172.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.64 155.35 38.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.097 0.862 . . . . 0.0 110.395 -170.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.12 -8.33 7.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.921 2.088 . . . . 0.0 110.68 175.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.415 HD12 ' H ' ' A' ' 88' ' ' LEU . 4.4 mp -58.2 -33.93 69.83 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.975 1.31 . . . . 0.0 110.935 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -65.66 -33.84 76.82 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.906 0.775 . . . . 0.0 111.459 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 36.9 mt -70.42 -46.49 63.83 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.1 mmt -55.54 -40.44 71.87 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.305 173.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.76 71.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.847 0.859 . . . . 0.0 110.04 -178.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.61 -45.02 99.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 118.33 0.513 . . . . 0.0 110.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.97 -49.27 78.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.422 0.556 . . . . 0.0 110.312 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -63.52 -43.59 96.72 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.337 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 96.8 m -61.71 -45.32 94.46 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.32 -45.89 78.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.45 1.023 . . . . 0.0 110.861 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -62.41 -43.33 99.07 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.429 0.633 . . . . 0.0 110.997 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.22 -37.33 72.05 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.346 -0.846 . . . . 0.0 110.947 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -60.53 -48.54 81.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.512 0.597 . . . . 0.0 110.587 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.4 mt -50.72 -51.23 51.9 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 173.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -55.0 -42.61 72.72 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.872 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -69.42 -48.72 60.12 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 119.577 1.08 . . . . 0.0 111.777 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 11.6 ptt? -73.6 -28.72 61.97 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.459 1.027 . . . . 0.0 112.003 -174.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 21.1 tp -85.4 -35.02 21.59 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -171.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 52.26 28.88 6.01 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.307 1.443 . . . . 0.0 113.765 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -153.59 -178.25 6.89 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.235 1.814 . . . . 0.0 106.89 169.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -48.07 131.89 15.71 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.895 0.878 . . . . 0.0 109.195 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 29.9 m -79.99 38.95 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 124.733 1.213 . . . . 0.0 110.22 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -78.2 171.39 15.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.613 1.165 . . . . 0.0 111.772 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -44.88 -61.21 1.69 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.079 1.752 . . . . 0.0 112.667 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -61.93 -41.43 97.94 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.949 -0.469 . . . . 0.0 110.337 -179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.31 -31.54 67.55 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.822 -0.549 . . . . 0.0 112.098 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -77.76 -32.99 52.93 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.09 -1.006 . . . . 0.0 109.96 173.494 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.53 -33.88 71.95 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.736 0.698 . . . . 0.0 110.923 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -71.15 -17.83 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.27 -0.894 . . . . 0.0 113.265 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -129.98 28.44 5.06 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.453 1.024 . . . . 0.0 112.789 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.76 -48.14 2.17 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.921 1.688 . . . . 0.0 112.722 174.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.94 -37.9 89.17 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.111 0.869 . . . . 0.0 111.725 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.96 -43.51 95.84 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 176.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.25 -49.04 78.53 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.98 0.912 . . . . 0.0 110.879 173.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.08 -48.32 76.33 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.513 0.597 . . . . 0.0 109.396 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.75 -37.08 85.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.177 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.44 95.73 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.916 0.78 . . . . 0.0 110.593 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.8 t -60.38 -45.62 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 118.906 0.775 . . . . 0.0 109.09 174.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -73.49 18.2 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.064 1.346 . . . . 0.0 112.991 176.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -135.54 -25.67 1.29 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.665 1.586 . . . . 0.0 110.757 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.71 -29.09 8.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.356 1.062 . . . . 0.0 109.552 171.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.8 t -138.04 147.5 25.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 119.685 1.129 . . . . 0.0 108.638 -171.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -144.28 126.19 15.34 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 125.473 1.509 . . . . 0.0 107.366 169.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.9 32.29 59.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 119.431 -0.649 . . . . 0.0 113.657 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.76 12.52 84.43 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.264 1.032 . . . . 0.0 113.672 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.9 t -121.13 141.26 42.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 30.3 pt -55.17 140.26 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-O 121.959 0.885 . . . . 0.0 110.049 174.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -113.66 -44.22 3.22 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 126.621 1.968 . . . . 0.0 107.512 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -145.74 161.84 38.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.0 m -148.19 38.69 0.89 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.193 0.997 . . . . 0.0 110.679 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -132.95 117.44 14.94 Favored Pre-proline 0 C--O 1.235 0.335 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.65 -42.93 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.077 1.851 . . . . 0.0 113.01 -169.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.257 1.9 pp0? -69.38 -27.53 65.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.938 -1.101 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.58 -43.53 69.24 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 119.628 1.103 . . . . 0.0 109.741 175.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 11.7 t -52.46 -49.91 41.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 170.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.6 t -63.2 -39.28 84.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.697 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -57.57 -51.1 70.86 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 119.515 1.052 . . . . 0.0 109.273 175.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -62.56 -40.67 97.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.636 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.67 -43.3 96.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 120.071 1.305 . . . . 0.0 109.632 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.22 79.16 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.211 0.604 . . . . 0.0 111.512 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.31 -39.28 78.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.036 1.734 . . . . 0.0 111.974 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.139 1.376 . . . . 0.0 110.095 -176.178 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.588 0.232 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.3 164.2 23.37 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.863 -0.523 . . . . 0.0 110.005 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.82 163.64 38.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.17 1.388 . . . . 0.0 108.873 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.45 -36.01 75.15 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.333 0.653 . . . . 0.0 111.31 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.3 mm -120.49 48.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 106.652 -1.611 . . . . 0.0 106.652 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 59.7 tp -55.33 -35.67 65.41 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.551 -0.718 . . . . 0.0 110.34 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -138.21 146.76 53.05 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 126.531 1.932 . . . . 0.0 106.04 169.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.54 155.07 67.67 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.363 2.042 . . . . 0.0 110.922 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 m -78.59 14.22 1.36 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.83 1.252 . . . . 0.0 112.901 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -148.68 177.44 9.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.188 2.195 . . . . 0.0 107.212 -176.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -56.29 128.67 36.92 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -63.98 -34.8 78.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.055 0.942 . . . . 0.0 110.186 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -157.13 160.6 2.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -174.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -123.06 -40.0 2.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.947 1.299 . . . . 0.0 110.088 -175.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.97 168.8 23.84 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.432 0.56 . . . . 0.0 111.179 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.4 mt -137.4 137.1 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 105.282 -2.118 . . . . 0.0 105.282 173.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -134.29 150.23 50.97 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.2 mt -137.19 120.09 20.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 169.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.7 mt -124.13 143.04 50.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -170.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.46 168.47 8.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.475 170.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -72.4 13.82 0.3 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.643 1.177 . . . . 0.0 113.794 -174.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -131.32 6.34 4.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.883 1.673 . . . . 0.0 110.327 169.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.87 5.96 59.55 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.397 1.475 . . . . 0.0 113.403 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -70.21 131.86 44.87 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 119.526 1.663 . . . . 0.0 109.918 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -60.64 118.79 7.01 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.51 -41.54 8.13 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 165.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -146.5 152.53 39.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.14 146.86 20.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 169.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -142.16 139.23 32.03 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 171.606 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -127.56 147.84 50.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 174.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -129.23 8.84 5.59 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.125 0.57 . . . . 0.0 110.571 -177.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -141.05 152.25 44.69 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.431 0.692 . . . . 0.0 111.81 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.68 -7.76 23.04 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.371 1.868 . . . . 0.0 113.962 -174.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 p -58.91 -42.73 90.33 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.149 -0.969 . . . . 0.0 112.157 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -145.16 72.26 14.6 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 119.079 0.854 . . . . 0.0 109.925 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -90.34 -1.17 5.39 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.811 2.341 . . . . 0.0 113.35 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.3 m -132.44 137.09 47.15 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.567 -169.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.4 t -46.87 -48.37 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.299 1.84 . . . . 0.0 112.683 -169.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -57.5 -48.0 80.41 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.417 0.553 . . . . 0.0 111.024 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -74.31 -33.35 63.17 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -61.34 -51.3 69.43 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.066 0.546 . . . . 0.0 110.714 174.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -61.49 -32.31 72.32 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.054 -1.029 . . . . 0.0 111.215 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -48.43 72.26 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -61.34 -38.43 86.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.406 0.683 . . . . 0.0 111.195 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.33 -44.94 93.48 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.41 1.484 . . . . 0.0 111.15 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -43.59 98.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.155 0.434 . . . . 0.0 109.84 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.29 -48.48 74.02 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.634 0.773 . . . . 0.0 110.946 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -59.27 -53.37 49.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -60.17 -44.85 94.71 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.648 0.379 . . . . 0.0 110.624 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -61.95 -47.61 84.11 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.278 0.631 . . . . 0.0 111.489 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -74.48 -48.66 25.95 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 122.787 0.435 . . . . 0.0 110.355 -170.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 p -59.18 -35.35 73.41 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.264 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -54.16 -26.76 29.65 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -77.91 -16.94 57.83 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 119.05 0.841 . . . . 0.0 112.778 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.7 p -78.33 173.24 12.53 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.364 0.984 . . . . 0.0 111.4 -174.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.22 -5.22 48.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.303 1.041 . . . . 0.0 112.125 169.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 m 77.77 143.51 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.547 2.739 . . . . 0.0 113.762 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 127.29 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 1 C-N-CA 133.338 4.655 . . . . 0.0 108.703 172.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.0 tt -154.42 157.3 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.698 1.199 . . . . 0.0 109.002 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.04 166.73 27.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.693 2.397 . . . . 0.0 107.98 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 tp -130.05 112.24 13.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 174.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -84.23 -165.52 1.18 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.04 1.336 . . . . 0.0 108.962 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.89 19.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.339 2.256 . . . . 0.0 114.369 -173.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.96 -3.0 0.47 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.559 1.552 . . . . 0.0 112.621 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.3 mt -126.32 131.98 51.72 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 118.353 1.076 . . . . 0.0 109.525 -170.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.0 m -75.68 141.61 42.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 84.5 t -137.97 117.94 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -98.2 146.23 8.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 169.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -155.66 162.72 40.54 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.989 0.359 . . . . 0.0 111.136 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -148.4 176.03 10.63 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.205 1.002 . . . . 0.0 108.636 170.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.6 p -141.26 148.6 40.09 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 m -144.7 141.87 29.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.0 mt 62.74 -78.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 126.879 2.072 . . . . 0.0 111.13 170.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -156.9 34.59 0.3 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.668 1.987 . . . . 0.0 108.931 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.5 tp -145.13 149.67 35.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.099 1.36 . . . . 0.0 109.784 -169.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -126.51 148.68 49.67 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.53 1.132 . . . . 0.0 109.231 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -137.34 140.55 41.55 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 125.378 1.471 . . . . 0.0 107.968 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -145.13 149.03 34.28 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 123.948 0.899 . . . . 0.0 110.501 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 96.5 t -136.32 136.54 48.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 169.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -127.44 137.77 56.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 -170.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -158.24 -177.39 31.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-O 121.742 0.635 . . . . 0.0 112.11 -176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 m -58.76 158.12 8.53 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.136 1.374 . . . . 0.0 112.188 -174.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 p -74.46 38.5 0.12 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.458 1.903 . . . . 0.0 111.058 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -69.05 167.93 14.94 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.978 1.311 . . . . 0.0 111.029 -171.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.69 -10.25 50.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.455 1.102 . . . . 0.0 113.375 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -148.01 171.19 16.22 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.903 1.281 . . . . 0.0 108.889 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.53 3.63 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.233 2.213 . . . . 0.0 110.76 -170.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.83 -31.68 72.78 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.472 1.109 . . . . 0.0 110.868 -173.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -33.44 75.82 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.871 0.759 . . . . 0.0 111.332 173.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.2 mt -71.19 -44.7 64.92 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.2 mmt -56.03 -41.0 74.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.282 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.39 -47.04 80.74 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.472 0.709 . . . . 0.0 110.3 -178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.1 t -62.01 -45.66 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-O 118.696 -0.668 . . . . 0.0 109.943 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 58.8 tp -61.21 -47.73 84.76 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.874 0.761 . . . . 0.0 110.331 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -64.56 -43.63 93.31 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.32 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 45.8 t -60.62 -50.61 72.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.268 0.627 . . . . 0.0 109.685 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.0 tp -61.97 -46.48 89.1 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.319 0.509 . . . . 0.0 110.992 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -64.67 -42.39 95.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.312 0.506 . . . . 0.0 111.046 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.73 -37.73 82.58 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 121.435 -0.791 . . . . 0.0 110.644 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.2 m -61.5 -46.73 88.77 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.664 0.785 . . . . 0.0 110.84 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.9 mt -54.72 -47.98 73.08 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.0 m -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.859 0.464 . . . . 0.0 111.879 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -73.12 -55.22 6.77 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.824 1.193 . . . . 0.0 109.69 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 67.0 mtm -66.03 -41.94 90.24 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.276 0.36 . . . . 0.0 111.751 -169.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.95 -35.86 77.26 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 118.041 0.382 . . . . 0.0 110.601 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.94 27.87 6.0 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.849 1.259 . . . . 0.0 112.455 -174.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -155.61 -175.34 5.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 126.739 2.016 . . . . 0.0 107.99 174.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.29 125.88 22.61 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.978 0.911 . . . . 0.0 108.789 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.3 m -77.95 46.73 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 125.371 1.468 . . . . 0.0 110.857 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.33 167.79 20.96 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.274 -0.891 . . . . 0.0 111.423 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -44.8 -54.17 6.64 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.104 1.762 . . . . 0.0 112.355 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -40.27 88.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.143 -0.348 . . . . 0.0 110.525 -176.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.5 -34.93 79.36 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.973 -0.455 . . . . 0.0 111.428 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.0 mp -67.87 -43.57 79.1 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 119.191 0.905 . . . . 0.0 110.46 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 69.7 tp -56.02 -37.26 68.95 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.28 0.491 . . . . 0.0 110.848 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -70.13 -18.81 63.24 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.279 1.032 . . . . 0.0 113.169 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -129.14 23.2 5.63 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.565 1.075 . . . . 0.0 111.442 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.65 -47.59 20.13 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.219 1.408 . . . . 0.0 111.832 -178.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -63.92 -39.73 94.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.941 0.791 . . . . 0.0 111.515 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.78 -43.6 95.97 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 tp -58.81 -50.44 73.95 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.287 1.035 . . . . 0.0 110.653 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -54.43 -49.03 70.94 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.481 0.712 . . . . 0.0 109.719 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.47 -33.87 76.01 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.601 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.94 80.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 118.859 0.754 . . . . 0.0 110.014 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 72.9 t -60.49 -41.04 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 118.658 0.663 . . . . 0.0 109.95 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.58 -24.83 67.96 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.402 0.681 . . . . 0.0 112.534 177.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -87.05 -34.73 19.08 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.576 -0.702 . . . . 0.0 110.683 177.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.86 -39.22 45.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.765 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 23.9 t -137.66 148.18 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 120.274 1.397 . . . . 0.0 111.851 -169.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -150.66 133.02 15.52 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.847 1.659 . . . . 0.0 108.033 169.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.66 24.99 54.84 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-O 119.487 -0.618 . . . . 0.0 114.632 173.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.07 18.33 69.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.379 1.09 . . . . 0.0 112.856 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.92 141.67 44.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.9 pt -70.55 154.96 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 119.684 -0.806 . . . . 0.0 109.859 176.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.6 mt -118.9 -19.28 8.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.029 1.331 . . . . 0.0 110.021 169.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -155.37 160.83 41.01 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 108.623 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -143.6 -5.98 0.81 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.558 1.143 . . . . 0.0 112.262 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.07 118.63 70.29 Favored Pre-proline 0 C--O 1.236 0.375 0 CA-C-N 119.735 1.152 . . . . 0.0 109.359 170.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -67.55 -30.94 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.902 1.735 . . . . 0.0 112.273 -174.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -64.64 -47.64 77.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -62.9 -38.69 91.94 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 118.392 0.542 . . . . 0.0 110.215 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.24 -58.49 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 30.1 m -67.0 -32.84 59.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.653 -173.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -61.13 -52.22 65.8 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.404 1.002 . . . . 0.0 109.987 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 80.0 mtt180 -61.52 -44.46 97.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 118.543 0.61 . . . . 0.0 110.091 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 15.2 t -58.45 -47.99 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.32 0.648 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.67 -29.92 56.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 122.681 0.392 . . . . 0.0 111.341 -171.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.27 -34.29 65.71 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.37 0.668 . . . . 0.0 111.108 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.1 mtm-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-N 118.375 0.534 . . . . 0.0 110.167 174.912 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 ttp . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -65.02 155.26 35.25 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.186 0.594 . . . . 0.0 110.195 176.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.63 146.86 52.94 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.239 0.616 . . . . 0.0 109.91 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -64.15 -50.04 69.72 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 173.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 38.1 mm -84.99 69.49 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 106.465 -1.68 . . . . 0.0 106.465 169.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.94 153.72 20.51 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 169.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -54.22 117.64 13.65 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 123.669 0.788 . . . . 0.0 108.943 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.4 151.81 23.09 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.11 1.873 . . . . 0.0 111.897 -169.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 p -75.02 -35.86 61.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.726 0.81 . . . . 0.0 109.126 169.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.4 tp -60.04 142.32 54.21 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.37 1.468 . . . . 0.0 109.426 170.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -56.16 130.29 43.63 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.566 1.147 . . . . 0.0 110.577 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.2 p -70.75 -32.09 69.13 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.408 0.683 . . . . 0.0 110.287 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.424 HG21 HG11 ' A' ' 129' ' ' VAL . 31.2 m -139.3 167.34 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.315 1.046 . . . . 0.0 109.173 -179.017 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -131.25 -27.94 1.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 117.369 -1.301 . . . . 0.0 110.591 173.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.77 165.66 29.98 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 120.179 1.354 . . . . 0.0 112.123 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.9 mt -135.03 136.85 51.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 169.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -133.57 149.75 51.64 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.5 mt -138.32 118.86 15.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 104.276 -2.49 . . . . 0.0 104.276 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 55.9 mt -122.71 144.92 48.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 -175.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.5 169.11 6.42 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.086 0.47 . . . . 0.0 110.519 169.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.78 -11.97 1.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.0 3.49 13.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.049 1.34 . . . . 0.0 110.743 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.16 6.41 55.69 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.09 1.328 . . . . 0.0 112.85 171.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.79 128.08 35.38 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 119.564 1.682 . . . . 0.0 109.869 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -60.9 120.83 10.93 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -101.96 -41.73 6.36 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 166.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -145.81 151.99 38.8 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.53 144.53 15.47 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 168.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -148.2 147.85 29.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -132.7 145.61 51.18 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -131.6 1.15 4.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.295 1.038 . . . . 0.0 111.493 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -134.05 162.62 31.59 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.925 0.89 . . . . 0.0 108.914 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -71.78 4.2 3.48 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.495 1.918 . . . . 0.0 113.611 -169.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -62.24 -48.5 79.66 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.445 1.098 . . . . 0.0 111.275 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -143.94 74.99 16.1 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 124.162 0.985 . . . . 0.0 108.989 -176.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.23 -1.88 6.96 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.582 2.188 . . . . 0.0 113.568 -172.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.6 m -134.22 139.21 45.63 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.098 0.959 . . . . 0.0 109.238 -169.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -43.73 -52.85 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.431 1.893 . . . . 0.0 112.98 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.99 -42.11 98.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.464 0.575 . . . . 0.0 111.28 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.27 -34.62 73.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -64.85 -49.81 69.08 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.289 0.635 . . . . 0.0 110.292 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.56 -35.69 70.66 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.449 -0.782 . . . . 0.0 111.033 177.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.44 -43.58 73.02 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.961 0.505 . . . . 0.0 109.932 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -62.43 -37.88 87.56 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.071 -0.393 . . . . 0.0 110.759 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -64.99 -43.12 93.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.72 1.608 . . . . 0.0 111.005 178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -59.27 -46.58 88.13 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.267 0.485 . . . . 0.0 109.86 172.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -46.67 83.58 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.731 0.812 . . . . 0.0 111.1 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.3 mm -57.43 -53.52 42.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 124.417 1.087 . . . . 0.0 108.344 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.46 -48.4 81.94 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.651 0.38 . . . . 0.0 110.366 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -56.95 -43.67 81.78 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.031 0.932 . . . . 0.0 111.911 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -76.36 -48.9 18.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.053 0.541 . . . . 0.0 109.937 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.9 p -65.96 -30.23 70.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.672 -0.642 . . . . 0.0 112.048 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -56.64 -24.42 48.09 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.486 -0.758 . . . . 0.0 111.782 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -110.64 21.41 16.6 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.31 1.444 . . . . 0.0 110.485 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.7 m -128.87 153.51 47.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.392 1.077 . . . . 0.0 109.322 -173.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -83.21 93.79 7.74 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.182 0.993 . . . . 0.0 109.048 176.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -45.4 140.85 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.468 1.907 . . . . 0.0 115.96 -171.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 144.73 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 1 C-N-CA 133.223 4.609 . . . . 0.0 107.231 170.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -151.92 156.93 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.833 1.253 . . . . 0.0 109.041 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 171.75 17.61 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.398 2.279 . . . . 0.0 107.559 173.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 tt -142.23 117.7 10.27 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.86 -1.904 . . . . 0.0 105.86 169.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 mp -111.94 103.75 11.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -169.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 61.34 -2.25 0.24 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.196 2.198 . . . . 0.0 115.324 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.8 -27.91 1.3 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 126.021 1.772 . . . . 0.0 111.33 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -85.77 132.64 34.09 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 118.314 1.057 . . . . 0.0 108.873 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 m -82.82 140.67 32.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 175.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 89.7 t -139.21 138.24 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -173.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.9 m -123.91 149.77 28.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -157.32 165.99 34.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.503 0.668 . . . . 0.0 111.876 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -151.16 159.6 44.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 127.305 2.242 . . . . 0.0 106.641 -169.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -138.42 144.45 40.18 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.7 m -138.74 119.65 14.34 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.039 1.336 . . . . 0.0 108.432 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.3 mp 62.58 -76.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 126.781 2.032 . . . . 0.0 113.061 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -143.39 21.84 1.86 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.607 1.563 . . . . 0.0 109.943 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.89 149.99 52.29 Favored 'General case' 0 N--CA 1.458 -0.075 0 C-N-CA 125.616 1.566 . . . . 0.0 109.387 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -130.4 142.18 50.52 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.983 1.313 . . . . 0.0 108.183 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -124.08 142.78 50.9 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.349 1.459 . . . . 0.0 107.087 -177.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -142.98 147.82 35.8 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.76 0.824 . . . . 0.0 109.251 -176.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.91 138.41 50.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.95 136.96 57.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 -172.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.07 -179.5 27.75 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-O 122.133 0.852 . . . . 0.0 112.192 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.4 m -59.62 165.89 2.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.696 1.599 . . . . 0.0 112.192 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -67.66 6.6 0.62 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.919 1.688 . . . . 0.0 114.541 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.29 122.94 17.85 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -175.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.16 -18.69 63.74 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.081 1.352 . . . . 0.0 114.555 -169.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -66.2 -32.43 73.86 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.705 -170.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.282 2.0 pp20? 48.39 -10.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.23 3.012 . . . . 0.0 118.463 -176.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 33.2 mt -63.8 -32.22 73.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 120.441 -1.412 . . . . 0.0 111.18 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -33.96 77.08 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.185 0.902 . . . . 0.0 111.532 174.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.3 mt -68.65 -47.35 66.77 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 19.2 mmt -55.4 -41.59 72.92 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.458 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.1 -51.69 66.92 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.282 0.633 . . . . 0.0 109.503 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.45 -44.81 99.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.223 0.465 . . . . 0.0 110.34 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.3 tp -61.31 -49.28 77.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.329 0.513 . . . . 0.0 110.471 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -65.21 -40.59 94.36 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.412 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.6 m -61.68 -46.94 87.56 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.442 0.565 . . . . 0.0 110.091 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.26 -51.35 66.52 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 118.55 0.613 . . . . 0.0 110.033 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -58.07 -47.18 83.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.215 0.606 . . . . 0.0 111.427 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -79.9 -29.21 39.83 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.474 -0.766 . . . . 0.0 111.894 -173.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.2 t -68.62 -43.55 76.11 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 119.249 0.931 . . . . 0.0 110.085 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 37.2 mt -53.33 -49.81 66.3 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 169.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.0 m -60.13 -32.01 70.61 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.22 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 35.3 mm-40 -65.82 -62.26 1.6 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 120.013 1.278 . . . . 0.0 109.513 174.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -72.65 -36.55 68.01 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -169.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.578 HD21 ' HB1' ' A' ' 113' ' ' ALA . 20.1 tp -73.88 -30.94 62.91 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.847 0.294 . . . . 0.0 111.352 -172.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 58.27 28.14 16.22 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.171 1.388 . . . . 0.0 113.08 172.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -150.15 176.56 10.73 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.935 2.094 . . . . 0.0 106.705 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -55.01 129.74 39.05 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.385 0.674 . . . . 0.0 109.719 169.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.419 HG12 HD23 ' A' ' 105' ' ' LEU . 24.5 m -81.5 48.06 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 109.727 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.11 176.74 4.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.124 -0.985 . . . . 0.0 111.737 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -46.84 -57.87 4.48 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.364 1.866 . . . . 0.0 112.836 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -64.8 -37.42 87.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.368 0.531 . . . . 0.0 110.674 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.578 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -68.26 -32.61 72.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.409 0.284 . . . . 0.0 110.879 -177.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.5 mp -75.02 -38.54 61.49 Favored 'General case' 0 CA--C 1.514 -0.404 0 O-C-N 120.594 -1.316 . . . . 0.0 111.821 172.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.7 tp -55.96 -39.28 71.55 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.48 0.582 . . . . 0.0 110.62 174.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -75.87 -10.57 59.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.33 24.93 4.16 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.726 1.148 . . . . 0.0 113.246 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -43.97 -44.9 7.51 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.042 1.337 . . . . 0.0 112.233 177.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.73 -40.73 95.82 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.042 0.837 . . . . 0.0 111.776 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.48 -42.95 98.82 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 176.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -55.75 -49.02 74.23 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.112 0.965 . . . . 0.0 110.449 172.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -58.03 -45.84 86.28 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.622 0.646 . . . . 0.0 109.851 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.09 -37.45 85.81 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 119.118 -0.468 . . . . 0.0 111.356 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.38 90.42 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 119.016 0.825 . . . . 0.0 110.096 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.97 -46.34 87.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.721 0.691 . . . . 0.0 109.746 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.7 -30.72 68.99 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.959 0.904 . . . . 0.0 112.661 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -85.79 -29.8 23.52 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.746 -0.596 . . . . 0.0 111.323 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 68.5 mt -78.99 -41.62 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.307 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' VAL . . . . . 0.424 HG11 HG21 ' A' ' 13' ' ' VAL . 0.9 OUTLIER -145.96 153.25 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 119.918 1.236 . . . . 0.0 110.836 -170.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -155.84 141.44 17.85 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.885 1.274 . . . . 0.0 108.799 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.61 25.08 54.85 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.423 -0.654 . . . . 0.0 114.125 173.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 86.35 8.81 77.24 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 118.077 0.939 . . . . 0.0 113.203 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.3 t -127.44 142.25 44.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 119.305 1.552 . . . . 0.0 106.953 -177.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -62.37 155.93 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.598 0.713 . . . . 0.0 110.33 171.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.6 mt -122.69 -23.41 5.12 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.919 1.688 . . . . 0.0 109.834 171.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -154.55 161.31 41.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.935 0.789 . . . . 0.0 109.315 173.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 9.1 p -144.74 34.17 1.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.406 1.482 . . . . 0.0 110.448 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.68 120.84 6.7 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.908 0.883 . . . . 0.0 109.924 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -64.73 -33.36 54.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.188 2.592 . . . . 0.0 114.608 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.292 2.5 pp0? -84.42 -27.38 27.63 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.09 0.859 . . . . 0.0 111.523 -176.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -68.74 -40.68 79.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.018 1.281 . . . . 0.0 108.755 168.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.3 t -55.09 -53.22 36.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 118.223 -0.894 . . . . 0.0 108.78 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.28 -37.12 79.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 119.966 1.257 . . . . 0.0 111.132 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 -48.44 81.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.584 0.629 . . . . 0.0 109.515 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -68.27 -34.74 76.73 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.853 0.751 . . . . 0.0 111.636 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 48.7 t -61.98 -43.81 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 119.182 0.901 . . . . 0.0 109.448 174.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.97 -32.12 73.14 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.506 0.594 . . . . 0.0 111.426 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 37.4 tp -73.16 -24.83 60.62 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.86 1.664 . . . . 0.0 112.293 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 . . . . . 0 C--O 1.25 1.123 0 CA-C-N 118.597 0.635 . . . . 0.0 110.257 172.728 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.682 0.277 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -62.16 -34.05 75.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.852 . . . . 0.0 111.289 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -146.46 152.39 38.94 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.411 1.884 . . . . 0.0 106.926 171.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -61.28 143.94 54.75 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.221 0.464 . . . . 0.0 110.559 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 21.0 mt 46.45 57.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 125.514 1.526 . . . . 0.0 109.114 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.08 -25.99 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.997 0.919 . . . . 0.0 112.561 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -123.56 78.85 55.15 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.01 171.04 18.73 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.508 2.806 . . . . 0.0 111.667 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.1 m -73.43 5.57 3.63 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.375 1.47 . . . . 0.0 114.045 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -147.95 174.8 11.53 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.203 1.401 . . . . 0.0 110.074 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -60.01 128.76 38.44 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.742 0.817 . . . . 0.0 110.669 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 32.4 p -71.34 -32.0 68.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 171.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.5 140.8 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -100.52 -25.25 14.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 117.513 -1.232 . . . . 0.0 109.787 171.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.1 167.77 23.72 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.768 1.167 . . . . 0.0 111.89 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mt -138.96 139.29 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mt -138.25 154.4 49.07 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.3 mt -138.05 120.46 18.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 103.814 -2.662 . . . . 0.0 103.814 168.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.9 mt -125.99 145.46 50.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -169.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 170.73 3.39 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.678 0.791 . . . . 0.0 110.905 170.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -63.48 2.33 0.44 Allowed 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -131.32 9.66 4.78 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.688 1.595 . . . . 0.0 110.738 175.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.09 19.97 48.22 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 118.645 -1.086 . . . . 0.0 113.095 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -78.34 132.68 37.52 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.778 1.789 . . . . 0.0 109.697 171.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 ttm180 -61.53 116.83 5.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.354 0.662 . . . . 0.0 109.673 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mt -85.53 -43.27 13.67 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 157.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -148.87 148.48 29.91 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.953 1.301 . . . . 0.0 108.188 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.03 146.7 14.41 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 3.3 mmpt? -141.28 149.14 40.88 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.65 1.58 . . . . 0.0 107.733 172.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -139.68 144.55 37.64 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.614 1.566 . . . . 0.0 107.596 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -135.0 -1.96 2.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.316 1.047 . . . . 0.0 112.041 -170.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -134.4 160.04 39.2 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.47 0.708 . . . . 0.0 109.447 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.95 3.89 4.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.846 2.059 . . . . 0.0 112.871 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -61.03 -47.62 85.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.663 1.185 . . . . 0.0 110.819 177.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -144.07 75.08 15.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.312 1.045 . . . . 0.0 108.888 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -90.03 -1.01 5.61 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.726 2.284 . . . . 0.0 113.687 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 m -134.34 137.87 44.49 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.017 0.927 . . . . 0.0 109.463 -169.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.7 t -46.09 -49.84 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.066 1.746 . . . . 0.0 112.866 -169.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.18 -47.68 82.67 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.559 0.618 . . . . 0.0 111.019 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -73.92 -32.47 63.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.148 0.431 . . . . 0.0 110.36 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -61.79 -51.15 69.45 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.089 0.555 . . . . 0.0 110.594 174.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.18 -35.55 75.62 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.354 -0.841 . . . . 0.0 110.85 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.53 78.59 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.57 -38.54 87.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 110.916 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.38 -42.75 99.66 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.465 1.506 . . . . 0.0 111.08 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -65.49 -41.97 92.66 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.583 0.629 . . . . 0.0 109.985 174.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.89 -46.16 78.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.052 0.541 . . . . 0.0 111.11 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.9 mm -60.56 -52.4 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -60.44 -46.01 91.6 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.742 0.701 . . . . 0.0 110.521 -177.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -55.66 -47.39 76.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.869 0.867 . . . . 0.0 111.628 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -67.69 -52.12 41.59 Favored 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 123.28 0.632 . . . . 0.0 110.227 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.401 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 36.2 p -70.7 -33.43 70.87 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.845 -0.534 . . . . 0.0 112.207 -169.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -64.71 -12.86 51.26 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.139 -0.976 . . . . 0.0 111.961 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -111.03 13.81 21.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.612 1.965 . . . . 0.0 111.361 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.8 m -120.33 159.48 24.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.556 1.142 . . . . 0.0 109.111 -176.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.24 31.84 0.45 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.675 1.59 . . . . 0.0 112.824 -169.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m 68.24 178.03 0.25 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.392 1.877 . . . . 0.0 113.603 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 11.1 pt-20 56.25 -44.05 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.415 3.886 . . . . 0.0 117.138 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -150.44 154.29 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 120.305 1.412 . . . . 0.0 109.259 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.15 163.8 36.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.839 2.056 . . . . 0.0 108.798 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.28 120.87 34.38 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -111.18 71.1 0.73 Allowed 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 126.167 1.787 . . . . 0.0 107.632 -172.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 62.84 7.95 2.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.533 1.533 . . . . 0.0 113.815 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 145.95 -33.91 1.47 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.327 1.918 . . . . 0.0 110.42 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.22 156.78 38.77 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.615 0.766 . . . . 0.0 109.141 170.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -117.06 138.77 51.39 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 77.8 t -136.33 139.31 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 -169.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.1 t -132.9 131.22 59.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.401 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 21.5 p90 -156.81 164.61 37.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -168.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 pttp -154.68 179.04 9.44 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.496 0.719 . . . . 0.0 109.232 169.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 p -138.34 146.06 41.89 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.4 m -147.9 146.03 28.88 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.461 1.104 . . . . 0.0 109.592 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 52.52 -83.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 127.03 2.132 . . . . 0.0 110.882 -172.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -152.81 29.43 0.52 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.82 2.048 . . . . 0.0 109.226 -176.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.2 tp -136.7 153.42 50.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.436 1.494 . . . . 0.0 110.27 -169.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -122.91 149.29 44.43 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.324 1.05 . . . . 0.0 109.125 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -136.89 141.56 42.75 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.587 1.555 . . . . 0.0 107.873 -172.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -145.18 150.24 36.39 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.074 0.95 . . . . 0.0 112.004 -169.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.4 t -137.19 138.74 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.51 137.91 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.7 -179.7 36.54 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.505 1.058 . . . . 0.0 113.006 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -172.94 0.67 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.595 -1.803 . . . . 0.0 109.658 175.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.8 t -142.35 161.34 38.27 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -155.23 -50.1 0.09 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.346 1.059 . . . . 0.0 109.285 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -150.4 -18.32 0.24 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.676 0.79 . . . . 0.0 111.828 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 50.2 p30 -155.48 171.74 19.41 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 123.823 0.849 . . . . 0.0 111.085 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -1.4 14.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.729 2.412 . . . . 0.0 110.518 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.35 -32.69 68.77 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.733 1.213 . . . . 0.0 111.697 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -34.34 76.39 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.722 0.692 . . . . 0.0 111.274 177.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -69.45 -43.45 73.25 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 46.0 mmm -59.72 -40.11 86.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.348 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.84 76.9 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.766 0.827 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.26 -43.18 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 118.583 -0.722 . . . . 0.0 110.185 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 tp -60.85 -48.51 81.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.112 0.869 . . . . 0.0 110.477 178.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -62.7 -46.4 88.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 119.341 -0.362 . . . . 0.0 110.317 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 89.7 m -60.61 -46.73 89.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.911 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.2 tp -61.01 -52.36 65.33 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 119.187 0.903 . . . . 0.0 111.024 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -66.01 -40.62 91.26 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.065 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.12 -31.58 66.16 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.497 -0.752 . . . . 0.0 111.311 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 71.0 m -62.58 -49.84 73.66 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.614 0.765 . . . . 0.0 110.312 172.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 74.8 mt -53.07 -46.64 68.66 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.3 m -58.68 -41.12 85.46 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 118.552 -0.737 . . . . 0.0 112.104 178.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -67.39 -42.04 83.99 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 119.828 1.195 . . . . 0.0 111.419 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.0 ptp -76.75 -36.22 57.24 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.14 0.882 . . . . 0.0 111.622 -175.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.85 -33.95 24.74 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 118.663 0.665 . . . . 0.0 112.015 -173.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 50.15 29.9 3.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.591 1.156 . . . . 0.0 112.822 -176.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -154.84 -178.07 6.96 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 126.316 1.847 . . . . 0.0 107.486 169.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -53.78 121.17 7.35 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.511 0.672 . . . . 0.0 111.104 176.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.1 m -79.32 50.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.373 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.98 175.99 6.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.041 0.936 . . . . 0.0 111.974 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -46.88 -56.56 6.12 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.369 1.468 . . . . 0.0 112.279 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -62.37 -44.47 96.4 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.137 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.69 83.76 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.501 0.591 . . . . 0.0 110.329 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.25 -38.04 75.05 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 118.498 -0.763 . . . . 0.0 112.081 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.24 -38.38 76.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.903 0.774 . . . . 0.0 110.831 176.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -72.04 -14.71 61.94 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -125.06 21.34 8.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.506 1.048 . . . . 0.0 111.923 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -48.37 -49.51 34.34 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.444 1.098 . . . . 0.0 112.215 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.49 -36.49 81.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.617 0.644 . . . . 0.0 111.361 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.15 -43.88 98.5 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 173.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -61.2 -49.34 77.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.68 1.192 . . . . 0.0 110.845 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -53.17 -49.96 65.59 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.131 0.878 . . . . 0.0 110.068 175.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 65.0 mt -65.89 -41.38 91.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 119.179 -0.439 . . . . 0.0 111.037 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.52 93.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.598 0.636 . . . . 0.0 110.294 178.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.9 t -57.81 -44.39 86.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 118.288 0.495 . . . . 0.0 109.702 175.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -66.77 -5.75 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.606 1.162 . . . . 0.0 113.63 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -112.15 -28.81 7.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.017 1.327 . . . . 0.0 110.555 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 82.5 mt -66.97 -43.17 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.453 1.024 . . . . 0.0 108.723 171.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.45 155.19 28.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 124.303 1.041 . . . . 0.0 109.856 -174.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -149.67 131.44 15.06 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.221 1.408 . . . . 0.0 107.814 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.22 30.78 55.65 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 119.28 -0.733 . . . . 0.0 113.201 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.59 12.56 84.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 118.268 1.034 . . . . 0.0 113.846 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 t -123.72 141.41 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.155 1.478 . . . . 0.0 107.038 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.0 pt -55.71 138.7 15.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.456 0.646 . . . . 0.0 110.174 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -122.1 -38.8 2.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.126 1.77 . . . . 0.0 108.564 -172.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.55 153.39 43.52 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 169.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.3 m -133.37 28.21 4.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.216 1.407 . . . . 0.0 110.305 -169.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -139.22 125.72 12.52 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.229 1.012 . . . . 0.0 108.71 176.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.23 -38.39 3.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.843 2.362 . . . . 0.0 113.71 -171.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -28.11 57.58 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.032 -1.043 . . . . 0.0 110.433 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 68.0 mm-40 -61.8 -50.41 72.41 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.326 0.966 . . . . 0.0 109.748 169.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 12.3 t -51.98 -57.14 4.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 124.103 0.961 . . . . 0.0 109.02 177.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.5 t -63.56 -43.68 98.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.756 -173.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -57.36 -52.57 64.83 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 118.44 0.564 . . . . 0.0 109.643 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -57.32 -47.14 82.31 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.113 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 33.1 m -75.9 -28.47 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-N 120.385 1.448 . . . . 0.0 112.031 -172.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.96 -35.31 62.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.526 0.603 . . . . 0.0 110.981 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 52.6 tp -67.9 -41.2 83.07 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.961 1.704 . . . . 0.0 111.27 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 124.478 1.111 . . . . 0.0 110.03 -179.373 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.7 mtt . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -63.81 -32.67 74.26 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.217 0.607 . . . . 0.0 111.495 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.7 162.65 40.66 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.859 1.663 . . . . 0.0 108.165 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.6 -33.17 72.34 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.182 0.593 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.2 mm -109.56 51.72 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 62.2 tp -53.95 -37.64 64.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.756 -0.59 . . . . 0.0 110.134 172.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.94 147.11 49.69 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 126.561 1.945 . . . . 0.0 106.069 169.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.29 166.65 29.01 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.603 2.202 . . . . 0.0 111.048 174.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.6 m -131.45 13.88 5.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.684 1.194 . . . . 0.0 111.479 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.431 HD23 ' H ' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -151.4 165.64 33.49 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.611 1.964 . . . . 0.0 106.913 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.431 ' H ' HD23 ' A' ' 10' ' ' LEU . 74.8 m-85 -57.87 120.1 7.87 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 169.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.3 p -73.19 -23.14 60.37 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.886 -176.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.3 m -138.87 163.04 27.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 C-N-CA 123.906 0.882 . . . . 0.0 108.754 173.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -123.04 -28.12 4.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 117.247 -1.358 . . . . 0.0 110.166 171.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.82 165.31 30.47 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 120.094 1.315 . . . . 0.0 112.144 175.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.3 mt -133.23 133.8 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 170.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -131.19 146.46 52.34 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.5 mt -142.69 114.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 103.419 -2.808 . . . . 0.0 103.419 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.2 mt -124.89 148.1 48.48 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.419 0.688 . . . . 0.0 109.318 -169.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.79 170.55 13.38 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.915 169.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -60.26 -17.15 40.06 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -99.56 -14.31 19.08 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.647 1.112 . . . . 0.0 110.939 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.58 12.22 13.48 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 125.674 1.606 . . . . 0.0 112.239 175.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.93 132.04 47.14 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.158 1.479 . . . . 0.0 109.751 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -68.23 82.59 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.716 1.607 . . . . 0.0 109.853 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.42 -47.95 77.22 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -148.99 150.68 33.25 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.682 0.793 . . . . 0.0 109.116 171.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.29 145.74 19.48 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 169.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -147.95 148.07 30.37 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -134.21 144.65 48.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -130.04 0.44 4.73 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.169 0.988 . . . . 0.0 111.514 -172.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -133.8 161.78 33.79 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.671 0.788 . . . . 0.0 109.244 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -72.68 4.9 3.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.476 1.91 . . . . 0.0 113.071 -169.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.8 p -62.67 -48.77 77.88 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.713 1.205 . . . . 0.0 110.954 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -143.24 73.36 17.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.311 1.045 . . . . 0.0 109.026 -176.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -88.28 -1.47 6.91 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.727 2.285 . . . . 0.0 113.582 -171.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.5 m -133.29 138.13 46.29 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.213 1.005 . . . . 0.0 109.012 -170.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -45.4 -50.59 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 126.133 1.773 . . . . 0.0 112.999 -169.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -60.28 -43.96 95.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.724 0.693 . . . . 0.0 111.07 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -71.53 -33.5 69.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.049 0.386 . . . . 0.0 110.104 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -62.32 -49.6 74.98 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.073 0.549 . . . . 0.0 110.047 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.37 -37.78 75.94 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.309 -0.869 . . . . 0.0 111.137 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.38 77.65 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.978 0.511 . . . . 0.0 109.681 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -61.94 -37.53 85.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.117 0.567 . . . . 0.0 110.914 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -63.74 -42.81 97.8 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.455 1.502 . . . . 0.0 111.059 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -62.61 -43.42 98.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.316 0.962 . . . . 0.0 109.812 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -48.76 77.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.979 0.512 . . . . 0.0 110.983 175.424 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.83 -51.99 63.46 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 C-N-CA 124.149 0.98 . . . . 0.0 108.969 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -59.34 -47.16 86.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.185 0.594 . . . . 0.0 110.107 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -60.21 -48.17 82.86 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.541 0.736 . . . . 0.0 111.361 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -70.13 -43.07 71.72 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.423 0.689 . . . . 0.0 110.827 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.8 p -67.5 -34.28 76.82 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.562 -0.712 . . . . 0.0 111.087 -176.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -65.51 -7.03 12.39 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.1 0.864 . . . . 0.0 112.853 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -119.11 25.02 10.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.689 1.996 . . . . 0.0 109.432 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.495 HG21 ' HB2' ' A' ' 60' ' ' ALA . 84.2 m -129.51 153.07 48.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.516 1.927 . . . . 0.0 107.211 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.99 -45.66 92.66 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.514 -173.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.5 m 145.81 -175.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 1 C-N-CA 132.458 4.303 . . . . 0.0 108.39 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.4 pt-20 57.76 -49.21 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 130.981 3.712 . . . . 0.0 116.413 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.1 tt -152.96 153.67 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 120.798 1.636 . . . . 0.0 110.484 -173.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.495 ' HB2' HG21 ' A' ' 55' ' ' THR . . . -145.5 159.93 42.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.227 1.411 . . . . 0.0 110.232 171.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -113.56 99.07 7.47 Favored 'General case' 0 CA--C 1.52 -0.204 1 N-CA-C 100.065 -4.05 . . . . 0.0 100.065 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.6 tp -65.32 -66.36 0.56 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.033 -168.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -146.22 6.97 1.01 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.332 1.853 . . . . 0.0 110.263 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.27 -41.46 1.25 Allowed Glycine 0 CA--C 1.526 0.744 0 C-N-CA 126.361 1.934 . . . . 0.0 108.283 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.9 mt -66.61 139.68 57.9 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 169.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.3 m -98.98 142.81 29.99 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.44 142.15 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 m -111.42 147.63 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 169.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -152.79 157.59 41.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.088 0.47 . . . . 0.0 110.73 174.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.443 ' HE2' ' CE2' ' A' ' 98' ' ' PHE . 18.1 ptmt -144.49 171.37 14.45 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 169.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 m -140.44 137.91 34.3 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -145.12 140.56 28.1 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.225 0.61 . . . . 0.0 109.864 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.9 mp 50.36 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 127.358 2.263 . . . . 0.0 111.374 -169.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -142.61 16.27 1.99 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.471 1.908 . . . . 0.0 110.492 -176.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.1 145.99 44.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.846 2.058 . . . . 0.0 108.097 -169.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.24 138.08 53.02 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -134.13 139.15 45.71 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.61 1.164 . . . . 0.0 108.039 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -144.78 147.11 32.53 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.862 0.865 . . . . 0.0 110.059 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 70.9 t -137.82 131.08 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.0 139.46 48.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 -172.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -157.39 179.23 33.3 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-O 122.58 1.1 . . . . 0.0 113.074 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -62.4 156.04 23.66 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.266 1.826 . . . . 0.0 112.73 -171.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -71.81 33.35 0.06 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 127.575 2.35 . . . . 0.0 112.325 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -70.96 179.0 2.9 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.846 1.658 . . . . 0.0 111.285 -172.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -63.96 -12.94 42.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.085 1.754 . . . . 0.0 113.333 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -146.04 163.69 34.46 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.137 0.975 . . . . 0.0 110.172 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -7.15 7.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.833 2.453 . . . . 0.0 110.298 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -56.99 -36.34 70.25 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.79 1.636 . . . . 0.0 110.368 177.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -64.78 -34.9 79.43 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.1 0.56 . . . . 0.0 112.161 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -47.71 69.03 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -42.68 67.69 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.201 1.0 . . . . 0.0 110.052 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.71 65.35 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.006 1.322 . . . . 0.0 110.212 -177.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.97 -44.04 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.136 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 65.9 tp -61.2 -48.04 83.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 118.506 0.593 . . . . 0.0 110.341 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.56 -44.45 96.31 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 119.126 -0.464 . . . . 0.0 110.406 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.6 m -61.47 -45.9 92.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.275 0.489 . . . . 0.0 110.473 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.71 -49.3 68.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.478 0.581 . . . . 0.0 109.968 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.443 ' CE2' ' HE2' ' A' ' 70' ' ' LYS . 51.3 t80 -62.23 -42.22 99.12 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.899 0.381 . . . . 0.0 111.114 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -69.62 -37.27 76.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.533 -0.73 . . . . 0.0 110.647 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.5 m -62.97 -44.79 95.07 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.731 0.696 . . . . 0.0 111.221 175.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.8 mt -52.55 -51.46 59.58 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.6 m -58.44 -40.41 82.5 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.602 0.564 . . . . 0.0 111.097 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -66.74 -44.34 81.76 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.59 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -81.54 -30.64 33.05 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.782 1.174 . . . . 0.0 112.179 -177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -75.78 -44.66 40.38 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 119.154 0.888 . . . . 0.0 111.907 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 50.85 34.65 10.66 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.23 1.012 . . . . 0.0 111.973 -170.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -152.8 -176.92 5.95 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.784 1.633 . . . . 0.0 108.15 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -50.29 126.33 14.64 Favored 'General case' 0 CA--C 1.522 -0.112 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 35.1 m -76.04 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.399 1.48 . . . . 0.0 110.002 169.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.04 174.78 9.47 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.425 1.09 . . . . 0.0 110.805 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -52.08 -48.62 64.59 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.614 1.166 . . . . 0.0 112.304 -170.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 41.7 tpt85 -65.88 -35.92 81.98 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.907 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.0 -39.23 66.2 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.733 0.697 . . . . 0.0 111.107 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.03 -45.97 86.09 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 121.563 -0.711 . . . . 0.0 109.351 171.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 67.3 tp -61.34 -38.38 86.71 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.202 0.601 . . . . 0.0 111.793 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -65.29 -28.11 69.1 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.94 21.85 9.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.803 0.729 . . . . 0.0 112.531 -169.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.56 -50.77 2.22 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 125.564 1.546 . . . . 0.0 112.691 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -65.58 -39.24 91.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.076 0.853 . . . . 0.0 111.541 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.74 -43.17 99.35 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.11 -49.42 77.94 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.123 0.969 . . . . 0.0 110.605 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.58 -46.87 80.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.758 0.708 . . . . 0.0 109.708 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -65.75 -40.05 91.69 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.084 -0.484 . . . . 0.0 110.749 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.98 96.6 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.981 0.81 . . . . 0.0 110.125 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.77 -46.11 90.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 118.923 -0.56 . . . . 0.0 109.727 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -63.42 -25.47 68.29 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -84.85 -40.03 17.6 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.626 -0.671 . . . . 0.0 111.228 173.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.37 -42.54 87.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 119.136 0.88 . . . . 0.0 109.799 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -139.05 150.07 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.072 0 CA-C-N 119.245 0.929 . . . . 0.0 110.592 -174.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -149.97 132.96 16.17 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 125.059 1.344 . . . . 0.0 108.365 177.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.74 25.98 56.77 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.506 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 79.56 14.27 81.47 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.299 1.049 . . . . 0.0 113.255 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 20.2 t -126.73 141.43 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 119.257 1.529 . . . . 0.0 107.388 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -57.31 138.67 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.658 0.742 . . . . 0.0 109.852 172.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -125.3 -36.63 2.47 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.321 1.849 . . . . 0.0 108.21 -172.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -140.19 156.63 46.43 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 169.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.3 m -151.21 39.34 0.67 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.302 -0.874 . . . . 0.0 110.936 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -140.71 120.19 8.55 Favored Pre-proline 0 C--O 1.234 0.284 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 -29.69 17.91 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.108 1.872 . . . . 0.0 111.622 -169.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -69.41 -42.65 74.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -66.61 -43.63 84.29 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 41.4 t -55.85 -55.14 19.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.473 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.9 p -63.96 -41.21 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 119.051 0.841 . . . . 0.0 110.556 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -64.01 -43.42 95.68 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.003 0.82 . . . . 0.0 110.235 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.07 -48.06 83.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.378 0.536 . . . . 0.0 110.307 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.9 m -73.68 -26.57 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 119.247 0.93 . . . . 0.0 111.387 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.89 -34.9 74.16 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.739 0.699 . . . . 0.0 111.2 172.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.3 mp -75.83 -30.27 58.92 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.02 0.928 . . . . 0.0 111.947 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 118.535 0.607 . . . . 0.0 109.835 175.074 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.936 0.398 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.11 171.03 17.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.176 1.39 . . . . 0.0 108.975 176.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.78 150.26 41.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.597 0.759 . . . . 0.0 110.283 175.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.15 -30.7 62.55 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.36 1.064 . . . . 0.0 111.825 178.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.6 pp -120.13 37.0 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.244 1.817 . . . . 0.0 110.758 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -52.49 -39.94 61.8 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -139.0 139.19 22.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 127.069 2.148 . . . . 0.0 105.244 168.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.36 164.45 35.58 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 122.474 2.116 . . . . 0.0 110.96 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 m -68.41 -16.58 63.97 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.148 0.979 . . . . 0.0 113.63 -176.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -153.34 -178.78 7.2 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.227 1.411 . . . . 0.0 110.452 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -38.16 129.73 1.26 Allowed 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.27 2.228 . . . . 0.0 112.639 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -72.38 -28.12 62.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.071 0.548 . . . . 0.0 110.688 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.49 164.01 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.335 1.054 . . . . 0.0 108.268 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -133.1 -31.75 1.25 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 117.589 -1.196 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.86 165.82 31.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.833 1.197 . . . . 0.0 111.352 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.1 mt -138.08 135.63 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.8 mt -136.03 149.15 48.69 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 58.3 mt -138.75 125.27 24.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.9 mt -127.41 147.05 50.28 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 123.967 0.907 . . . . 0.0 108.964 -169.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -65.68 169.12 6.69 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -68.31 -15.13 63.45 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.626 1.17 . . . . 0.0 110.856 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -76.75 -7.2 54.93 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.062 -1.024 . . . . 0.0 112.06 171.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.18 51.16 29.14 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -169.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -130.32 136.35 49.04 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.578 1.151 . . . . 0.0 109.067 -173.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -60.59 124.28 19.9 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.211 0.605 . . . . 0.0 110.147 -174.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.1 mt -102.48 -41.19 6.38 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 158.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -145.25 151.13 37.9 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.746 0.818 . . . . 0.0 109.413 172.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.99 144.48 13.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.913 0.885 . . . . 0.0 108.69 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -149.7 149.76 31.08 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.869 0.868 . . . . 0.0 108.854 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -135.21 144.27 46.85 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 126.093 1.757 . . . . 0.0 106.786 -174.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -132.85 -8.94 3.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.785 -170.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.33 20.98 7.34 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.248 0.931 . . . . 0.0 112.87 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.2 t70 63.83 12.77 7.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.281 1.832 . . . . 0.0 113.602 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 p -62.84 -44.35 96.38 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.886 1.274 . . . . 0.0 110.555 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -141.0 83.69 13.77 Favored Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 106.409 -1.701 . . . . 0.0 106.409 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -92.5 0.03 3.95 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.667 2.244 . . . . 0.0 113.625 -170.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.0 m -136.24 139.39 42.7 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.195 0.998 . . . . 0.0 109.062 -169.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.7 t -43.83 -53.78 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 126.17 1.788 . . . . 0.0 112.845 -169.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -62.26 -44.21 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.572 0.624 . . . . 0.0 111.05 -173.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.38 -36.12 78.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -64.0 -50.35 68.87 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -56.7 -37.33 70.77 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.47 -0.769 . . . . 0.0 110.954 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.58 -44.82 77.25 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.866 0.466 . . . . 0.0 109.966 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.19 -36.95 83.46 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.4 -0.333 . . . . 0.0 110.645 175.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -65.18 -39.13 92.48 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.558 1.543 . . . . 0.0 111.231 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -64.5 -44.48 90.82 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.474 -0.766 . . . . 0.0 109.919 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.03 -48.15 76.51 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.083 -0.484 . . . . 0.0 110.571 174.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -55.11 -53.93 29.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 124.771 1.228 . . . . 0.0 108.714 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -64.82 -45.96 83.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.088 0.404 . . . . 0.0 110.588 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.44 -44.62 92.9 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 121.938 -0.476 . . . . 0.0 111.315 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtm -64.83 -50.6 66.05 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.4 p -70.84 -30.08 66.4 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.427 -0.796 . . . . 0.0 112.495 -169.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.65 -14.23 60.79 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.73 1.15 . . . . 0.0 113.36 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.43 9.09 21.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.229 1.012 . . . . 0.0 112.321 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.2 m -111.62 157.6 20.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.431 1.092 . . . . 0.0 109.013 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -80.19 30.45 0.27 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.616 1.566 . . . . 0.0 112.971 -170.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.4 m 65.07 -176.8 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.338 1.855 . . . . 0.0 113.635 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.311 10.4 pt-20 56.57 -45.45 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 131.581 3.952 . . . . 0.0 116.84 -176.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.0 tt -154.07 152.49 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 120.626 1.557 . . . . 0.0 110.084 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.08 177.58 9.76 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.81 1.644 . . . . 0.0 108.422 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.5 tt -141.87 122.16 13.94 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 170.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.54 140.77 29.04 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.286 1.034 . . . . 0.0 109.878 -169.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 51.18 28.1 3.88 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.943 1.297 . . . . 0.0 112.215 -176.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.4 -3.27 87.23 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 125.205 1.383 . . . . 0.0 113.816 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.7 mt -106.57 135.26 48.39 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 119.395 1.598 . . . . 0.0 109.226 -174.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 m -73.58 141.46 46.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 173.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.5 p -141.05 137.2 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.702 -0.624 . . . . 0.0 109.699 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.44 148.11 11.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 105.512 -2.032 . . . . 0.0 105.512 169.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 29.2 p90 -155.81 163.79 39.37 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.046 0.451 . . . . 0.0 111.377 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.86 175.89 11.23 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -140.67 142.14 34.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 m -146.16 141.38 27.43 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.832 0.853 . . . . 0.0 109.016 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.4 mp 54.43 -83.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.735 2.014 . . . . 0.0 110.829 -173.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -152.63 28.52 0.55 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.393 1.877 . . . . 0.0 109.482 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.406 HD23 ' CZ ' ' A' ' 77' ' ' PHE . 57.5 tp -132.85 147.37 52.3 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.967 1.707 . . . . 0.0 109.121 -169.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -125.34 141.27 52.17 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.406 ' CZ ' HD23 ' A' ' 75' ' ' LEU . 18.3 m-85 -134.49 143.54 47.53 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.865 1.266 . . . . 0.0 108.582 -170.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -147.2 145.61 29.55 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.185 0.994 . . . . 0.0 110.933 -169.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 94.0 t -135.81 129.49 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 169.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -122.04 138.07 53.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 -169.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.66 -175.33 24.86 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 122.287 0.937 . . . . 0.0 112.211 -177.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.3 m -59.8 159.01 9.47 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.362 1.465 . . . . 0.0 112.28 -173.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.81 25.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 127.483 2.313 . . . . 0.0 112.599 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -73.07 -179.67 3.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.954 1.302 . . . . 0.0 112.495 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -113.61 29.98 7.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.513 1.525 . . . . 0.0 113.066 -169.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 88' ' ' LEU . 2.7 p30 -128.41 -39.51 1.67 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 116.563 -1.684 . . . . 0.0 113.592 169.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.251 8.6 pm0 49.79 -16.73 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 128.36 2.664 . . . . 0.0 117.441 -173.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' ' 86' ' ' ASN . 35.5 mt -58.98 -34.23 71.59 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 127.213 2.205 . . . . 0.0 110.893 177.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -65.57 -34.09 77.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.257 0.935 . . . . 0.0 111.738 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.0 mt -68.46 -46.88 68.6 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -53.18 -42.95 66.72 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.17 0.988 . . . . 0.0 109.958 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.33 -50.23 68.59 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.379 1.472 . . . . 0.0 110.265 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.67 -42.92 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 118.651 0.659 . . . . 0.0 110.168 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.76 -49.49 76.2 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.753 0.706 . . . . 0.0 110.488 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.06 -43.69 98.5 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.098 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.7 m -61.07 -46.1 92.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.529 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 tp -65.56 -46.4 79.64 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 119.756 1.162 . . . . 0.0 110.982 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -64.06 -42.82 96.88 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.031 0.443 . . . . 0.0 110.771 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -68.57 -38.81 81.04 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.536 -0.728 . . . . 0.0 110.959 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.1 m -60.9 -48.96 79.43 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.261 0.624 . . . . 0.0 110.666 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.7 mt -50.92 -49.29 59.93 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.844 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -68.23 -53.78 22.3 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.668 1.122 . . . . 0.0 111.032 178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 13.4 ptt? -70.63 -30.18 66.75 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.613 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.409 HD12 HG12 ' A' ' 109' ' ' VAL . 17.9 mt -75.99 -43.06 46.23 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.59 0.632 . . . . 0.0 112.171 174.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 51.54 36.22 16.49 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.505 1.122 . . . . 0.0 110.793 -169.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -150.05 170.9 17.8 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 127.074 2.149 . . . . 0.0 107.045 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -57.55 132.68 53.92 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.262 0.625 . . . . 0.0 109.799 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.409 HG12 HD12 ' A' ' 105' ' ' LEU . 3.9 m -89.37 42.08 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 124.579 1.152 . . . . 0.0 111.115 -169.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.6 178.02 1.09 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.619 1.168 . . . . 0.0 112.113 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -46.41 -54.63 8.75 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.455 1.102 . . . . 0.0 111.778 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -63.27 -42.15 99.11 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.715 0.234 . . . . 0.0 111.614 -176.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.312 0.0 OUTLIER -79.55 -31.98 42.08 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.409 -1.432 . . . . 0.0 111.254 175.861 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.99 -41.72 92.68 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.815 0.734 . . . . 0.0 111.269 170.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -74.48 -10.62 59.74 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.592 -0.693 . . . . 0.0 112.607 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.96 27.32 4.9 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.472 1.109 . . . . 0.0 112.878 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.1 mmt -43.17 -43.9 4.85 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.741 1.216 . . . . 0.0 112.723 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -63.81 -42.22 97.72 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.203 0.91 . . . . 0.0 111.211 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.3 96.4 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 tp -55.61 -51.9 65.61 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.844 1.257 . . . . 0.0 110.219 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -57.43 -47.32 82.1 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.013 0.525 . . . . 0.0 109.613 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 69.5 mt -65.0 -39.22 93.13 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.091 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.97 -44.33 89.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.843 0.747 . . . . 0.0 110.563 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 39.9 t -56.28 -48.24 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.53 6.8 0.98 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.52 1.528 . . . . 0.0 113.57 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -126.16 -23.28 3.91 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.743 1.617 . . . . 0.0 110.682 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 48.0 mt -84.35 -37.78 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.9 159.35 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 119.797 1.181 . . . . 0.0 111.239 -172.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -159.99 138.03 10.08 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.482 1.513 . . . . 0.0 108.366 169.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.59 26.53 57.3 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-O 119.434 -0.648 . . . . 0.0 114.464 171.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.49 13.77 75.28 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-N 118.215 1.007 . . . . 0.0 113.13 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 t -128.84 141.46 46.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 29.8 pt -64.16 158.95 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.734 0.778 . . . . 0.0 110.071 170.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.7 mt -116.98 -39.9 3.19 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.714 1.606 . . . . 0.0 108.769 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -155.68 160.97 40.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.624 1.169 . . . . 0.0 108.419 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.5 p -138.03 37.88 2.35 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.658 1.583 . . . . 0.0 109.799 -173.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -136.1 120.13 12.75 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.48 -34.11 6.14 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.355 2.037 . . . . 0.0 112.149 -170.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -67.23 -45.66 76.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -65.73 -38.73 89.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.668 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 5.0 t -56.48 -53.58 38.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 119.141 0.882 . . . . 0.0 109.895 173.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 70.7 t -64.57 -36.49 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.725 1.148 . . . . 0.0 110.372 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.32 -50.81 72.29 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.989 0.813 . . . . 0.0 110.239 174.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.1 mtt-85 -59.54 -43.46 93.51 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 111.102 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 51.1 t -59.0 -43.6 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.624 1.102 . . . . 0.0 110.048 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.2 -32.66 70.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.024 0.53 . . . . 0.0 111.691 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.9 tp -73.49 -28.65 62.04 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.268 1.827 . . . . 0.0 112.268 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 123.735 0.814 . . . . 0.0 109.891 175.643 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -140.76 163.41 32.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.502 1.521 . . . . 0.0 107.715 176.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.39 140.18 58.85 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 123.207 0.603 . . . . 0.0 109.527 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.38 -39.12 59.55 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.9 mt -79.87 62.49 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 169.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.8 tp -60.07 -27.06 66.66 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.967 0.907 . . . . 0.0 112.072 -172.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.54 108.43 13.28 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 171.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.88 153.37 68.47 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.408 2.072 . . . . 0.0 112.019 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.0 m -73.52 -5.12 38.12 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.804 1.241 . . . . 0.0 112.691 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -147.44 177.9 8.86 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.776 1.63 . . . . 0.0 109.778 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -37.7 126.44 1.15 Allowed 'General case' 0 C--O 1.235 0.293 0 C-N-CA 128.159 2.584 . . . . 0.0 115.09 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 m -71.94 -38.75 69.76 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 168.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -141.78 135.26 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 126.452 1.901 . . . . 0.0 106.555 175.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -92.55 -36.66 12.91 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 0.0 110.736 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.67 167.29 28.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.996 0.816 . . . . 0.0 111.947 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.3 mt -135.33 135.4 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 104.893 -2.262 . . . . 0.0 104.893 171.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.6 mt -133.02 148.68 52.24 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.469 ' CG2' HD11 ' A' ' 75' ' ' LEU . 57.5 mt -136.78 113.18 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 102.763 -3.051 . . . . 0.0 102.763 169.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.2 mt -122.06 146.95 46.7 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.401 0.68 . . . . 0.0 109.678 -169.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.41 169.81 5.53 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 168.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -14.87 59.75 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.38 1.072 . . . . 0.0 112.413 173.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -75.22 -9.33 58.45 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.193 0.997 . . . . 0.0 112.139 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.83 51.47 15.09 Favored Glycine 0 C--N 1.339 0.737 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -140.06 133.45 29.97 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.259 1.023 . . . . 0.0 108.684 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 124.84 22.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.279 0.491 . . . . 0.0 111.609 -170.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.8 mt -82.45 -37.42 25.44 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 153.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -145.55 151.97 38.98 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.055 1.342 . . . . 0.0 108.853 170.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -154.7 147.57 24.49 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -138.34 135.16 35.1 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 171.429 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -123.54 129.77 51.68 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -103.66 -24.51 13.36 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -55.07 158.46 2.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.086 2.554 . . . . 0.0 112.575 169.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -119.52 1.39 11.16 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.795 1.638 . . . . 0.0 111.867 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 m -75.81 -35.25 60.08 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.792 1.237 . . . . 0.0 110.084 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -130.15 67.91 80.37 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 125.287 1.435 . . . . 0.0 108.784 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -89.14 -1.38 6.21 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.814 2.343 . . . . 0.0 113.713 -173.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 m -137.63 148.92 46.2 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.894 0.878 . . . . 0.0 110.313 -169.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.7 t -45.54 -53.61 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 126.327 1.851 . . . . 0.0 112.733 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -54.61 -47.94 72.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 118.593 0.633 . . . . 0.0 111.064 -175.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -75.47 -34.16 60.88 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 -176.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -63.07 -46.81 85.7 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.815 0.846 . . . . 0.0 110.625 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -63.86 -34.24 77.49 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.281 0.946 . . . . 0.0 111.068 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -47.22 78.33 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.903 -0.498 . . . . 0.0 109.897 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -61.6 -40.02 93.3 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.95 0.9 . . . . 0.0 110.805 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -57.41 -49.9 74.74 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.654 1.581 . . . . 0.0 111.168 172.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -62.4 -40.96 98.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.808 1.186 . . . . 0.0 110.53 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -48.46 77.96 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.028 0.531 . . . . 0.0 110.641 173.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.6 mt -60.85 -48.05 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.08 0 C-N-CA 123.712 0.805 . . . . 0.0 109.481 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -58.84 -45.91 88.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.484 0.714 . . . . 0.0 110.158 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -63.02 -42.13 99.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.857 0.463 . . . . 0.0 112.066 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -68.86 -50.46 49.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.885 0.474 . . . . 0.0 110.471 -177.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.5 p -61.55 -35.15 76.96 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 123.733 0.813 . . . . 0.0 112.89 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.45 0.3 3.11 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -119.93 33.48 5.6 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.307 1.443 . . . . 0.0 109.761 -171.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.4 p -135.97 -174.4 3.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.069 0.948 . . . . 0.0 111.116 -169.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -78.63 6.02 9.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.77 1.228 . . . . 0.0 111.814 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m 68.79 31.25 4.51 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.264 1.826 . . . . 0.0 115.347 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.46 -16.69 4.31 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.917 0.487 . . . . 0.0 111.154 169.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.1 tt -164.74 156.28 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.361 1.064 . . . . 0.0 109.127 -171.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.82 171.81 14.62 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.351 1.861 . . . . 0.0 108.965 170.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -131.94 116.76 17.56 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.5 mt -78.15 -128.49 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.18 1.392 . . . . 0.0 108.535 -175.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -82.16 2.47 31.38 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.127 -0.983 . . . . 0.0 111.698 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.16 -33.29 0.51 Allowed Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.951 1.739 . . . . 0.0 110.474 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.0 mt -67.06 155.42 38.73 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.836 0.854 . . . . 0.0 109.423 173.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 55.8 m -112.45 145.2 40.6 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -138.56 130.32 37.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.0 m -97.45 146.04 8.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -156.49 167.14 31.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.124 0.42 . . . . 0.0 111.021 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -155.19 178.59 10.03 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.616 1.166 . . . . 0.0 108.103 169.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.1 p -142.42 148.59 38.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.91 0.484 . . . . 0.0 109.847 170.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.1 m -146.74 143.21 28.53 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.833 1.253 . . . . 0.0 108.936 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.2 mp 52.5 -87.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.507 1.923 . . . . 0.0 111.141 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -144.9 16.86 1.59 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.589 1.956 . . . . 0.0 109.76 -178.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.469 HD11 ' CG2' ' A' ' 18' ' ' ILE . 23.4 tp -120.22 144.07 47.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.971 2.108 . . . . 0.0 108.397 -169.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -122.55 146.02 47.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -135.51 137.47 42.14 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 -171.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -146.66 150.64 35.82 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.883 0.873 . . . . 0.0 110.529 -171.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 83.9 t -140.39 129.75 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.53 144.13 27.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -162.2 -175.76 33.57 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 121.814 0.674 . . . . 0.0 112.203 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 155.31 23.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.192 1.397 . . . . 0.0 111.343 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -56.23 -46.61 79.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.189 0.996 . . . . 0.0 110.677 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 15.0 t80 51.07 -169.83 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.204 2.202 . . . . 0.0 112.935 173.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -82.72 -18.29 41.34 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.356 -0.84 . . . . 0.0 111.405 175.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -157.49 176.94 12.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 125.478 1.511 . . . . 0.0 109.662 -175.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.79 4.18 8.13 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.119 2.167 . . . . 0.0 110.512 -174.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.8 mt -69.63 -32.4 71.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.558 1.143 . . . . 0.0 111.093 -173.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -34.16 77.53 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.248 0.931 . . . . 0.0 111.149 173.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.1 mt -66.76 -48.3 69.52 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.8 mmt -54.34 -42.85 70.71 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.029 0.531 . . . . 0.0 110.335 174.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.6 84.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.707 0.803 . . . . 0.0 110.502 -177.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.72 -43.67 96.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.062 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.9 tp -61.2 -49.15 78.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.131 0.878 . . . . 0.0 110.417 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -63.48 -42.91 98.55 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.306 -178.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.56 -51.89 67.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.66 -47.52 83.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.439 0.563 . . . . 0.0 110.26 -176.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -65.4 -40.16 93.06 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.976 0.353 . . . . 0.0 111.497 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -71.72 -32.87 68.23 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.266 -0.896 . . . . 0.0 111.191 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -61.06 -49.89 75.5 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.685 0.794 . . . . 0.0 110.268 174.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.8 mt -52.44 -51.24 60.23 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -59.05 -19.68 46.32 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -84.78 -55.08 4.28 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 120.637 1.562 . . . . 0.0 110.44 171.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 23.0 ptt? -78.11 -7.44 57.0 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -171.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 30.0 tp -144.68 59.35 1.32 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 127.291 2.236 . . . . 0.0 106.124 -171.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -52.55 -17.69 1.37 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.092 . . . . 0.0 114.929 -170.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -66.14 -166.15 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.45 1.023 . . . . 0.0 111.217 170.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -76.8 9.13 3.05 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.257 24.0 m 42.76 41.69 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 125.84 1.656 . . . . 0.0 112.914 -175.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -75.52 176.16 7.84 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.262 1.025 . . . . 0.0 111.184 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -49.85 -49.59 48.62 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.133 0.973 . . . . 0.0 112.972 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -62.9 -40.37 97.36 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.037 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.19 94.24 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.509 0.595 . . . . 0.0 110.305 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -59.78 -49.76 76.45 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.874 0.87 . . . . 0.0 110.107 175.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.33 -40.43 74.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.693 1.197 . . . . 0.0 110.98 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.87 -14.12 62.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.822 0.849 . . . . 0.0 113.086 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -133.72 22.38 3.93 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.919 0.887 . . . . 0.0 112.284 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.3 mmt -45.6 -45.37 13.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.301 1.44 . . . . 0.0 111.872 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.85 -40.29 94.92 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.433 1.015 . . . . 0.0 111.7 -177.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.0 -42.23 94.81 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 177.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 tp -57.09 -51.26 69.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.235 1.014 . . . . 0.0 110.493 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -55.5 -46.86 76.92 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.337 0.655 . . . . 0.0 109.286 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.57 -41.83 96.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.893 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -59.82 -45.35 92.66 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.613 1.097 . . . . 0.0 110.496 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.26 -42.71 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.616 0.644 . . . . 0.0 109.831 175.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -66.17 -26.34 67.37 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.376 0.67 . . . . 0.0 112.804 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -79.47 -34.67 41.23 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.163 0.892 . . . . 0.0 110.892 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 81.4 mt -79.56 -40.36 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.015 -174.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.6 t -133.9 145.56 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.302 0.955 . . . . 0.0 110.166 -169.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -146.16 131.92 19.0 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.415 1.486 . . . . 0.0 107.456 169.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.56 25.1 54.73 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 123.555 0.598 . . . . 0.0 113.705 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.09 22.92 78.65 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.241 1.02 . . . . 0.0 113.387 -177.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 58.5 t -128.73 140.43 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 176.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.0 pt -69.08 159.36 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-O 121.377 0.608 . . . . 0.0 110.395 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.8 mt -121.71 -34.2 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.136 1.375 . . . . 0.0 109.512 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -156.09 158.18 37.29 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.743 1.217 . . . . 0.0 108.477 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.5 m -135.5 -3.81 2.35 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.664 1.585 . . . . 0.0 111.627 177.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -77.26 116.34 56.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 119.316 0.962 . . . . 0.0 108.743 169.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.65 -33.91 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.563 2.176 . . . . 0.0 112.109 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -68.04 -44.41 76.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -68.36 -34.57 76.31 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.171 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.76 -51.6 68.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 119.182 0.901 . . . . 0.0 109.587 170.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 63.8 t -63.19 -36.92 77.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.768 1.167 . . . . 0.0 110.613 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -46.84 87.95 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.197 0.908 . . . . 0.0 110.154 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 48.0 mtp180 -60.01 -44.51 94.54 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.089 175.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 78.1 t -58.48 -46.33 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 119.697 1.135 . . . . 0.0 109.707 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.53 -33.11 74.4 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.358 0.663 . . . . 0.0 111.663 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 64.7 tp -71.35 -31.42 67.32 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.93 1.692 . . . . 0.0 111.644 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.947 175.651 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ptt? . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.76 0.314 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -149.25 165.36 32.12 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.103 1.361 . . . . 0.0 107.988 175.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -153.23 0.5 0.25 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.199 1.4 . . . . 0.0 113.23 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 61.6 tp -139.3 -37.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.528 1.131 . . . . 0.0 110.674 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -120.34 53.56 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.6 mt -64.33 163.43 13.04 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 168.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -50.17 120.26 11.7 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.923 0.889 . . . . 0.0 109.361 179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.35 147.41 41.67 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.165 1.91 . . . . 0.0 111.931 -169.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -136.79 39.82 2.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.568 1.947 . . . . 0.0 107.596 172.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.6 pp -144.14 -174.21 4.22 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.467 1.907 . . . . 0.0 109.947 -169.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -132.62 142.46 49.13 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.024 1.33 . . . . 0.0 108.003 -172.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -68.33 -31.08 70.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.428 0.558 . . . . 0.0 109.622 176.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.49 125.97 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 169.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.443 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 65.1 mttm -81.05 -32.18 34.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 117.986 -1.007 . . . . 0.0 109.091 171.162 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.56 168.15 26.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.961 0.8 . . . . 0.0 111.735 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.9 mt -136.65 138.02 46.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 104.303 -2.48 . . . . 0.0 104.303 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mt -137.0 151.0 48.47 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -138.19 120.2 18.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 103.343 -2.836 . . . . 0.0 103.343 169.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.7 mt -126.05 147.0 49.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.45 169.41 6.01 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.181 0.515 . . . . 0.0 110.845 171.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -9.66 0.65 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 116.572 2.064 . . . . 0.0 116.572 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -119.95 9.37 11.24 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.145 1.378 . . . . 0.0 110.586 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.24 19.6 54.83 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.635 1.112 . . . . 0.0 112.469 173.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.4 133.28 39.94 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.358 1.579 . . . . 0.0 109.671 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -55.89 126.02 23.9 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.111 0.965 . . . . 0.0 108.98 176.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.3 mt -116.81 -45.73 2.77 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 165.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -143.83 152.69 41.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.54 148.63 19.76 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -141.7 136.12 30.52 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 171.075 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -125.73 146.82 49.59 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -130.61 -34.11 1.58 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.914 0.886 . . . . 0.0 111.329 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -78.93 159.59 27.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 172.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -78.53 7.79 6.19 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.935 1.694 . . . . 0.0 111.95 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 p -64.69 -45.99 84.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.244 1.418 . . . . 0.0 111.42 -177.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.9 70.88 29.5 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.338 1.055 . . . . 0.0 109.213 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -86.26 -1.46 8.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.573 2.182 . . . . 0.0 113.538 -173.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.8 m -134.52 138.35 44.59 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.126 0.97 . . . . 0.0 109.684 -169.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.0 t -46.31 -49.05 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.299 1.839 . . . . 0.0 112.937 -169.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -57.15 -46.57 82.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.383 0.538 . . . . 0.0 110.816 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.27 -32.07 60.93 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.286 -0.259 . . . . 0.0 110.349 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -62.72 -51.25 67.92 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 122.941 0.496 . . . . 0.0 110.203 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -59.64 -34.29 72.61 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.566 -0.708 . . . . 0.0 110.764 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.1 -47.28 74.72 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.745 0.418 . . . . 0.0 109.954 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -61.14 -36.63 80.29 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.829 0.451 . . . . 0.0 110.916 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -65.77 -40.94 92.51 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.17 1.388 . . . . 0.0 111.276 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -66.68 -39.24 88.04 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.245 0.93 . . . . 0.0 110.109 173.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -48.74 76.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.992 0.517 . . . . 0.0 110.622 171.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -56.74 -54.6 27.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.109 0 C-N-CA 124.475 1.11 . . . . 0.0 108.513 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -58.72 -48.78 79.97 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.328 0.651 . . . . 0.0 110.208 -176.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -60.74 -45.13 95.48 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.319 0.648 . . . . 0.0 111.894 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -70.02 -48.9 56.14 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 34.5 p -67.5 -28.18 67.62 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.591 -0.693 . . . . 0.0 112.088 -174.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.34 -18.76 60.19 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 118.796 0.725 . . . . 0.0 111.896 174.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtt-85 -113.76 19.22 16.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.751 1.62 . . . . 0.0 110.482 -172.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.3 m -131.49 154.44 48.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.759 1.224 . . . . 0.0 109.07 -169.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.79 88.73 4.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.31 1.044 . . . . 0.0 109.306 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.9 m -46.66 136.95 7.35 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 126.171 1.788 . . . . 0.0 115.808 -169.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.74 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 1 C-N-CA 133.031 4.533 . . . . 0.0 107.75 172.093 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 tt -153.43 158.92 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.386 1.474 . . . . 0.0 108.569 178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.34 165.04 34.28 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.72 2.008 . . . . 0.0 108.778 173.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -131.21 104.32 6.99 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 102.16 -3.274 . . . . 0.0 102.16 170.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -76.65 -64.87 1.02 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -168.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -141.77 6.55 1.83 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.837 1.655 . . . . 0.0 110.617 -173.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.4 -39.13 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 126.442 1.972 . . . . 0.0 109.169 -173.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.6 mt -72.98 132.98 44.11 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.406 0.682 . . . . 0.0 109.869 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.2 m -83.41 142.91 30.65 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.8 t -135.67 138.13 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.15 133.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.6 p90 -156.73 164.31 38.27 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -169.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -152.33 177.47 10.54 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.698 1.199 . . . . 0.0 108.989 172.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.0 p -143.66 147.87 34.94 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.255 0.622 . . . . 0.0 109.38 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.0 m -146.97 137.99 23.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.483 1.113 . . . . 0.0 108.894 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 mp 53.16 -84.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 127.483 2.313 . . . . 0.0 112.551 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -143.92 23.29 1.73 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.795 1.638 . . . . 0.0 109.552 -176.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 tp -132.04 145.35 51.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.63 1.572 . . . . 0.0 109.152 -169.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -125.85 146.11 49.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.41 138.45 46.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -144.3 148.81 35.29 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 123.568 0.747 . . . . 0.0 110.109 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -134.44 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 104.432 -2.433 . . . . 0.0 104.432 170.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.27 134.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -173.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.443 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -156.98 177.08 34.05 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-O 122.398 0.999 . . . . 0.0 113.172 -177.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.3 m -63.68 164.36 9.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 112.867 -1.666 . . . . 0.0 109.5 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -128.09 28.23 5.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.943 0.897 . . . . 0.0 110.597 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -60.37 -40.91 92.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.738 0.815 . . . . 0.0 112.968 -169.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -156.19 -23.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -145.9 165.77 27.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.339 0.972 . . . . 0.0 111.634 -171.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.8 -7.55 5.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.327 2.651 . . . . 0.0 110.326 177.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.66 -33.27 72.56 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.664 1.186 . . . . 0.0 110.775 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -64.09 -34.28 77.69 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.135 0.88 . . . . 0.0 111.819 174.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.22 -42.02 63.11 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.9 mmt -58.2 -40.75 82.37 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.521 171.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.06 -50.13 71.83 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.827 0.851 . . . . 0.0 109.815 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.42 -45.07 99.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 118.918 -0.563 . . . . 0.0 109.94 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 39.3 tp -60.47 -48.89 79.8 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.475 0.579 . . . . 0.0 110.304 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.46 -44.87 93.22 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.381 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 87.7 m -62.78 -43.85 97.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.523 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.9 tp -64.68 -51.73 60.93 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.785 0.72 . . . . 0.0 110.158 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -61.31 -42.04 97.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.396 0.278 . . . . 0.0 110.701 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.98 -38.56 66.62 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.593 -0.692 . . . . 0.0 111.483 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 m -61.51 -43.89 98.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.133 0.879 . . . . 0.0 110.379 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 mt -57.71 -45.76 85.31 Favored 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.2 m -61.4 -26.4 67.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.829 -0.605 . . . . 0.0 112.235 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -75.34 -53.13 9.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.819 1.19 . . . . 0.0 110.365 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 3.0 ptp -69.85 -39.42 76.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.012 0.824 . . . . 0.0 112.076 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.27 -37.82 60.76 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.532 0.606 . . . . 0.0 110.172 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 48.11 33.53 3.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.47 1.508 . . . . 0.0 113.028 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -153.31 -172.21 4.16 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.92 2.088 . . . . 0.0 107.421 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -50.0 122.9 7.26 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.804 0.842 . . . . 0.0 109.322 173.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 m -78.03 40.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 C-N-CA 125.029 1.332 . . . . 0.0 110.251 170.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.19 172.56 12.64 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.673 1.189 . . . . 0.0 112.231 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -43.77 -60.23 1.89 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.981 2.112 . . . . 0.0 112.874 -177.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -63.11 -46.11 88.87 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.726 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.71 82.08 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.943 0.792 . . . . 0.0 111.405 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.3 mp -74.14 -36.21 64.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.978 175.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.3 tp -58.63 -37.19 75.39 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.162 0.892 . . . . 0.0 110.956 171.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -73.9 -15.42 61.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 175.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -124.58 25.87 7.41 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.581 1.082 . . . . 0.0 111.454 -173.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.32 -48.63 18.25 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.908 1.283 . . . . 0.0 112.007 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.98 -39.51 94.3 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.721 0.691 . . . . 0.0 111.343 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.97 96.74 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.03 -50.6 72.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.609 1.163 . . . . 0.0 110.357 174.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -55.41 -48.07 74.93 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.028 0.531 . . . . 0.0 109.816 178.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.9 mt -65.56 -37.8 87.73 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.17 0.588 . . . . 0.0 111.397 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.37 -47.08 83.58 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 118.872 0.76 . . . . 0.0 109.906 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.95 -46.21 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.3 -2.92 4.92 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.125 1.37 . . . . 0.0 113.804 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -117.16 -12.94 10.52 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.749 1.22 . . . . 0.0 112.005 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 59.8 mt -87.9 -40.39 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.278 0.945 . . . . 0.0 108.503 173.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.32 156.24 21.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 124.936 1.294 . . . . 0.0 109.901 -172.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -149.8 136.44 19.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.252 1.421 . . . . 0.0 107.217 169.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.97 29.07 50.62 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 119.242 -0.755 . . . . 0.0 113.182 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.08 10.67 85.28 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 118.299 1.049 . . . . 0.0 113.835 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.12 133.33 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-N 119.079 1.439 . . . . 0.0 107.265 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.1 pt -57.77 145.15 9.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.085 0.554 . . . . 0.0 110.393 173.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -133.81 -14.22 2.46 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.202 1.001 . . . . 0.0 112.018 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -149.86 159.88 44.02 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.9 m -150.69 41.81 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.874 1.27 . . . . 0.0 109.464 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -139.94 119.86 9.05 Favored Pre-proline 0 C--O 1.235 0.325 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 173.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -30.82 13.18 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.056 1.837 . . . . 0.0 112.114 -169.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.18 -41.47 85.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -68.27 -42.1 80.08 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.473 0.579 . . . . 0.0 109.685 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 28.6 t -55.96 -55.8 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 118.845 -0.597 . . . . 0.0 109.471 176.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 5.2 p -65.26 -33.16 61.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 119.604 1.093 . . . . 0.0 110.798 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -60.59 -44.32 96.38 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.177 0.899 . . . . 0.0 110.566 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -63.57 -42.65 98.3 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.469 -0.769 . . . . 0.0 110.935 175.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.1 t -58.18 -42.2 82.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.968 0.804 . . . . 0.0 109.745 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.11 77.46 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.578 0.751 . . . . 0.0 111.902 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.94 -39.22 79.68 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.479 0.711 . . . . 0.0 111.386 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 54.9 mtp180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.427 -176.487 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 tmt? . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -147.88 155.63 41.82 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 174.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -135.7 -11.49 2.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.059 1.344 . . . . 0.0 113.072 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -147.98 155.3 41.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.521 1.055 . . . . 0.0 109.512 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.4 mm 46.6 41.09 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.308 1.443 . . . . 0.0 109.76 -171.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 69.1 tp -58.99 -34.2 71.57 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.565 0.746 . . . . 0.0 109.53 171.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -136.82 157.46 74.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 127.209 2.203 . . . . 0.0 106.027 169.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.53 38.21 0.55 Allowed 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 112.293 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 m -55.23 -42.73 73.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 0.0 110.026 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.1 tp -79.34 114.89 18.63 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 104.403 -2.443 . . . . 0.0 104.403 168.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -51.6 131.9 30.04 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.761 0.824 . . . . 0.0 111.904 -169.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.6 m -58.1 -35.56 71.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.699 1.599 . . . . 0.0 110.649 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -155.24 151.34 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -117.27 -30.42 5.6 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 117.585 -1.198 . . . . 0.0 111.747 -173.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.58 166.6 26.71 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 119.837 1.199 . . . . 0.0 111.656 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.1 mt -137.03 136.45 47.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -133.3 148.22 51.91 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.7 mt -139.06 118.18 13.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 169.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.4 mt -122.68 146.71 47.23 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -173.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 168.81 8.16 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.219 0.533 . . . . 0.0 110.31 169.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -12.23 1.54 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -115.97 3.64 13.69 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.94 1.296 . . . . 0.0 110.919 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.99 5.23 55.06 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.073 1.32 . . . . 0.0 113.084 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -69.8 133.76 47.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.426 1.613 . . . . 0.0 109.89 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -61.15 123.87 18.94 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 118.504 0.593 . . . . 0.0 109.653 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -100.08 -40.86 7.4 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 162.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -150.09 152.93 35.55 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.458 172.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.17 146.84 19.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 168.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.454 ' HE2' ' H ' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -147.46 146.78 29.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 170.437 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.454 ' H ' ' HE2' ' A' ' 29' ' ' LYS . 79.7 m-85 -133.6 151.72 51.75 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.969 1.708 . . . . 0.0 106.662 -177.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -135.92 1.4 2.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.869 0.868 . . . . 0.0 111.887 -175.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -133.68 158.31 43.59 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.737 0.815 . . . . 0.0 109.447 -176.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.52 5.19 3.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.358 2.263 . . . . 0.0 112.609 -173.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 p -62.21 -50.09 73.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.645 1.178 . . . . 0.0 110.532 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -142.68 64.71 15.84 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 124.193 0.997 . . . . 0.0 109.992 -174.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -82.18 -2.02 11.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.778 2.319 . . . . 0.0 113.598 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.5 m -138.01 143.68 40.71 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.914 0.886 . . . . 0.0 110.287 -169.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.8 t -45.62 -51.3 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 126.491 1.916 . . . . 0.0 113.127 -169.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -58.67 -46.64 86.75 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.799 0.727 . . . . 0.0 110.893 -176.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -70.37 -34.48 72.65 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.639 0.376 . . . . 0.0 110.165 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -63.2 -52.04 63.87 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.231 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -60.18 -35.35 75.17 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.894 0.77 . . . . 0.0 111.348 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.15 -49.92 70.24 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -63.4 -39.47 94.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.589 0.355 . . . . 0.0 111.023 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.07 -40.55 98.03 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.927 1.691 . . . . 0.0 111.564 178.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -69.32 -40.96 77.32 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.648 -0.657 . . . . 0.0 110.001 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.12 -48.78 73.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.979 0.512 . . . . 0.0 110.557 171.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.521 HD13 HD22 ' A' ' 62' ' ' LEU . 2.9 mm -54.86 -59.92 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 C-N-CA 125.133 1.373 . . . . 0.0 108.092 178.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -57.65 -45.33 85.62 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.629 0.772 . . . . 0.0 111.323 -172.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -57.84 -52.92 63.5 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 122.687 0.395 . . . . 0.0 110.507 176.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -63.9 -45.83 87.57 Favored 'General case' 0 C--O 1.23 0.062 0 CA-C-O 119.431 -0.318 . . . . 0.0 110.191 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.2 p -68.27 -32.06 71.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 119.205 0.911 . . . . 0.0 111.996 -172.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -73.51 0.55 12.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.442 1.019 . . . . 0.0 112.981 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -136.92 35.42 2.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.948 1.299 . . . . 0.0 110.451 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.3 m -135.88 156.98 47.95 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.387 1.875 . . . . 0.0 108.14 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -80.17 86.09 5.64 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.327 1.051 . . . . 0.0 109.055 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.7 m -50.57 144.27 8.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -169.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 145.45 -42.84 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 1 C-N-CA 133.553 4.741 . . . . 0.0 105.823 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -157.35 160.15 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.748 1.219 . . . . 0.0 108.973 -178.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.23 174.57 15.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.894 1.678 . . . . 0.0 110.207 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -136.7 116.89 13.46 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 176.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.521 HD22 HD13 ' A' ' 48' ' ' ILE . 10.2 mp -127.63 117.79 22.66 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.236 1.414 . . . . 0.0 107.296 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 50.68 31.49 5.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.121 1.368 . . . . 0.0 112.765 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.03 -16.03 61.59 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.859 1.218 . . . . 0.0 113.471 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.0 mt -91.21 134.15 34.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.456 1.628 . . . . 0.0 109.258 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 61.3 m -76.18 141.82 41.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 172.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.2 t -133.67 137.87 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -128.65 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 174.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -158.19 164.72 36.26 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.292 0.496 . . . . 0.0 112.218 -169.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -148.42 171.54 15.88 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.756 1.222 . . . . 0.0 108.352 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 p -145.47 143.91 30.29 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 169.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 17.1 m -147.24 142.89 27.71 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 109.665 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.4 mt 63.87 -81.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.382 1.873 . . . . 0.0 111.68 169.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -151.61 27.26 0.65 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.354 1.861 . . . . 0.0 109.151 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.2 tp -138.98 147.35 42.07 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.967 1.707 . . . . 0.0 110.062 -168.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -129.53 144.99 51.5 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.364 1.466 . . . . 0.0 107.454 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -132.85 137.19 46.63 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.433 1.493 . . . . 0.0 107.236 -172.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -146.13 151.19 37.27 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.728 0.695 . . . . 0.0 110.479 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.0 t -138.22 141.58 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 105.018 -2.215 . . . . 0.0 105.018 169.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.22 141.12 44.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 -172.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.89 -178.91 36.2 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 121.739 0.633 . . . . 0.0 113.062 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -62.57 164.8 7.04 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 113.973 -1.114 . . . . 0.0 110.205 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.1 m -124.68 43.96 2.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.866 0.866 . . . . 0.0 111.021 -169.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -71.91 -166.64 0.23 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 122.863 0.465 . . . . 0.0 110.21 169.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -58.41 -3.6 0.3 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 117.049 2.24 . . . . 0.0 117.049 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.69 167.69 25.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 120.27 1.396 . . . . 0.0 111.211 176.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.82 -0.91 2.78 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.486 2.715 . . . . 0.0 110.295 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.8 mt -63.65 -32.55 74.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.792 1.237 . . . . 0.0 109.937 -175.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -34.53 78.51 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.896 0.771 . . . . 0.0 111.355 175.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 mt -70.57 -45.19 65.87 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.5 mtp -58.94 -37.43 76.71 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.832 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.13 74.02 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.776 0.83 . . . . 0.0 110.364 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.6 t -59.05 -46.34 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.7 tp -58.05 -49.96 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.993 0.517 . . . . 0.0 110.366 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -63.6 -43.55 96.6 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 119.116 -0.469 . . . . 0.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.3 m -64.21 -42.18 96.73 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.491 0.587 . . . . 0.0 110.709 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.3 tp -67.93 -46.62 71.0 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.638 0.654 . . . . 0.0 110.241 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -62.34 -42.95 99.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.679 0.392 . . . . 0.0 111.046 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -76.58 -37.93 55.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.364 -0.835 . . . . 0.0 111.174 -176.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.7 p -63.13 -39.67 95.35 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.641 1.11 . . . . 0.0 110.442 175.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 11.6 mt -54.35 -52.64 60.96 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 m -56.21 -33.42 65.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.885 0.474 . . . . 0.0 111.928 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -69.25 -59.24 3.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.086 173.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.6 ptt? -69.6 -31.52 69.71 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.061 1.301 . . . . 0.0 113.472 -169.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.84 -35.42 74.73 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.824 0.738 . . . . 0.0 111.794 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? 49.08 33.29 4.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.424 1.09 . . . . 0.0 112.039 -171.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -155.21 175.66 13.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.076 2.151 . . . . 0.0 106.585 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -62.48 136.31 57.84 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -76.16 51.97 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.204 1.802 . . . . 0.0 111.02 -174.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.08 169.99 17.36 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.508 1.123 . . . . 0.0 111.745 -177.369 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -47.47 -55.42 9.09 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.366 1.866 . . . . 0.0 112.799 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -66.36 -38.27 87.19 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.221 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.76 -35.84 82.38 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.337 0.971 . . . . 0.0 110.864 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.99 -42.88 80.12 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 118.94 0.791 . . . . 0.0 110.685 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 58.1 tp -58.26 -37.4 74.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.667 0.667 . . . . 0.0 111.211 176.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -69.61 -18.45 63.61 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.104 0.962 . . . . 0.0 113.011 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -126.23 24.67 6.8 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.225 1.01 . . . . 0.0 111.525 -171.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -44.35 -49.34 9.6 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.475 1.51 . . . . 0.0 112.424 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.63 -42.48 98.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.205 0.911 . . . . 0.0 110.952 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.95 -43.88 98.24 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.14 -50.46 73.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.391 1.076 . . . . 0.0 110.837 175.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -55.06 -48.78 73.0 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.383 0.673 . . . . 0.0 109.871 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 97.1 mt -71.27 -32.27 68.5 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.416 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.46 -44.56 96.12 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.288 0.949 . . . . 0.0 109.71 173.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.35 -47.89 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 118.794 0.725 . . . . 0.0 109.638 174.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -61.12 -26.73 67.87 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -87.9 -28.95 21.22 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.118 0.967 . . . . 0.0 111.515 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.11 -43.35 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-N 119.089 0.859 . . . . 0.0 109.507 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 p -142.01 146.77 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.03 0.932 . . . . 0.0 110.39 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -144.49 138.93 27.95 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.02 1.328 . . . . 0.0 107.424 169.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.73 29.53 49.72 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.573 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.48 19.88 79.73 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 118.201 1.001 . . . . 0.0 113.417 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 61.3 t -130.94 133.59 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.6 pt -64.61 146.91 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.84 -12.35 3.75 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.888 0.875 . . . . 0.0 111.401 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.87 156.0 43.26 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 169.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.7 m -151.76 41.66 0.69 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.422 1.089 . . . . 0.0 109.735 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -142.36 120.5 7.44 Favored Pre-proline 0 C--O 1.235 0.299 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 174.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.81 -28.93 19.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.237 1.958 . . . . 0.0 111.775 -169.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -70.98 -39.96 72.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.78 -41.39 75.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 118.89 0.768 . . . . 0.0 109.609 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 42.1 t -55.3 -56.27 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.16 -34.6 71.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 118.979 0.809 . . . . 0.0 110.819 -174.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -59.17 -50.77 72.76 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.039 0.836 . . . . 0.0 109.904 176.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -62.05 -40.3 95.29 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.881 -0.512 . . . . 0.0 111.135 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 65.3 t -64.07 -37.48 79.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.777 0.717 . . . . 0.0 110.654 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.35 -37.71 71.67 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.755 1.162 . . . . 0.0 111.071 175.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.0 tp -70.18 -26.09 63.74 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.48 1.912 . . . . 0.0 112.698 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 C-N-CA 124.861 1.264 . . . . 0.0 112.184 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.209 0 N-CA-C 110.421 -0.214 . . . . 0.0 110.421 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.15 -14.83 57.68 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.009 1.114 . . . . 0.0 114.009 -173.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.86 -7.74 55.22 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.185 -0.947 . . . . 0.0 112.666 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.7 tp -142.08 -34.34 0.46 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.168 0.894 . . . . 0.0 112.542 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.3 mt -134.26 55.0 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -175.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.48 -36.51 73.86 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.473 0.709 . . . . 0.0 109.87 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -138.4 147.45 55.39 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 126.31 1.844 . . . . 0.0 106.214 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.79 169.12 21.93 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.729 2.286 . . . . 0.0 110.926 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -130.26 23.74 5.2 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.88 1.272 . . . . 0.0 110.202 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -152.36 169.47 22.46 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 127.007 2.123 . . . . 0.0 108.878 -171.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -91.64 154.38 19.06 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.674 0.79 . . . . 0.0 109.867 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 m -65.35 -41.21 94.08 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 169.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -139.36 139.3 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 123.85 0.86 . . . . 0.0 108.739 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -83.53 -37.83 22.53 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 169.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.61 168.28 20.17 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 118.513 0.597 . . . . 0.0 112.125 -173.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mt -133.28 137.47 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 104.94 -2.244 . . . . 0.0 104.94 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.9 mt -133.76 157.7 45.2 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.521 0.728 . . . . 0.0 109.373 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.489 ' CG2' HD11 ' A' ' 75' ' ' LEU . 9.8 mm -138.31 119.77 17.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.368 -2.827 . . . . 0.0 103.368 169.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -122.54 144.73 48.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.705 0.764 . . . . 0.0 109.158 -174.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -67.87 169.7 9.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.767 169.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -77.22 36.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.883 2.073 . . . . 0.0 111.389 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -149.62 7.26 0.65 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.278 2.231 . . . . 0.0 110.816 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.19 47.1 74.9 Favored Glycine 0 C--N 1.343 0.946 0 O-C-N 121.053 -1.029 . . . . 0.0 110.548 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -122.99 133.26 54.37 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 108.873 -177.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -64.76 119.38 10.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -173.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.1 mt -92.42 -42.38 9.79 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 159.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -148.65 154.69 40.03 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.803 0.841 . . . . 0.0 109.886 171.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.11 148.98 22.56 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -140.88 137.09 32.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 171.593 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -124.26 146.87 48.49 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -130.09 3.83 4.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.751 0.82 . . . . 0.0 110.992 -176.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -136.49 153.13 51.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.667 0.787 . . . . 0.0 111.054 -174.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.37 -0.49 12.54 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.285 2.234 . . . . 0.0 113.076 -173.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 p -65.6 -38.21 88.8 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.992 -1.068 . . . . 0.0 111.578 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -143.41 64.69 14.1 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.031 0.832 . . . . 0.0 110.467 -177.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -86.78 -1.02 8.11 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.851 2.367 . . . . 0.0 113.083 -175.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.6 m -133.71 137.51 45.31 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.399 1.08 . . . . 0.0 109.224 -169.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -50.64 -44.41 25.4 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 125.048 1.339 . . . . 0.0 113.47 -169.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -57.98 -45.77 86.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.667 0.667 . . . . 0.0 111.135 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.08 -35.98 64.28 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -60.26 -52.56 64.77 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.178 0.591 . . . . 0.0 109.887 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -57.78 -39.73 78.18 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.595 0.758 . . . . 0.0 110.647 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.65 83.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.098 0.559 . . . . 0.0 110.184 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -64.08 -38.66 91.87 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.44 0.696 . . . . 0.0 110.952 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -60.21 -46.56 89.33 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.631 1.972 . . . . 0.0 110.711 174.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.89 -46.29 91.2 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.026 0.83 . . . . 0.0 110.228 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -47.04 77.65 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.503 0.721 . . . . 0.0 110.752 177.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.81 -51.34 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.035 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -60.66 -46.56 89.87 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.892 0.769 . . . . 0.0 110.272 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -55.37 -43.71 75.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.455 1.102 . . . . 0.0 111.736 178.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -75.24 -49.73 18.4 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.999 0.52 . . . . 0.0 110.417 -177.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.1 p -68.57 -30.66 69.47 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.731 -0.605 . . . . 0.0 111.887 -172.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -58.22 -23.85 57.16 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.291 -0.881 . . . . 0.0 111.541 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.41 20.95 17.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.487 1.515 . . . . 0.0 110.339 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 84.4 m -125.29 156.6 38.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 108.949 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -84.62 35.1 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.526 1.53 . . . . 0.0 112.679 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.7 m 65.86 -176.91 0.19 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.249 1.82 . . . . 0.0 113.446 178.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.312 9.6 pt-20 56.31 -42.11 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 131.536 3.934 . . . . 0.0 117.006 -176.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.7 tt -158.02 151.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 120.245 1.384 . . . . 0.0 110.024 -173.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.81 177.74 9.27 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.434 1.893 . . . . 0.0 108.291 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 tt -140.57 125.61 18.43 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 170.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -77.29 -65.88 0.9 Allowed 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -169.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -142.72 4.04 1.49 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.195 1.798 . . . . 0.0 110.915 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.48 -40.95 0.67 Allowed Glycine 0 CA--C 1.525 0.666 0 C-N-CA 125.773 1.654 . . . . 0.0 109.319 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.84 126.91 29.96 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 170.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.1 m -80.22 146.21 31.84 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.4 p -136.71 121.15 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.42 142.4 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.865 -2.642 . . . . 0.0 103.865 168.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.42 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 16.2 p90 -152.43 167.11 29.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.555 0.693 . . . . 0.0 110.892 176.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -154.78 154.26 32.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -172.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -140.01 130.93 26.1 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -149.92 148.21 28.83 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.179 0.591 . . . . 0.0 109.633 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.4 mp 53.28 -89.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.772 2.029 . . . . 0.0 111.147 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -147.6 33.97 0.86 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.772 2.029 . . . . 0.0 108.903 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.489 HD11 ' CG2' ' A' ' 18' ' ' ILE . 50.3 tp -140.19 150.65 44.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.69 1.596 . . . . 0.0 110.47 -168.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -126.28 144.76 50.68 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -129.61 143.83 51.0 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.284 1.834 . . . . 0.0 107.764 -173.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -149.52 150.35 32.17 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.459 1.027 . . . . 0.0 111.774 -172.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.5 t -139.58 119.66 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -104.53 138.01 31.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 106.187 -1.782 . . . . 0.0 106.187 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.68 176.73 31.54 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-O 122.369 0.983 . . . . 0.0 112.666 177.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.8 m -61.49 157.05 17.95 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.619 1.568 . . . . 0.0 112.328 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 m -72.92 34.38 0.07 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.01 2.124 . . . . 0.0 112.083 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -70.28 176.98 3.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.429 1.492 . . . . 0.0 111.355 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -63.96 -12.91 41.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.07 1.748 . . . . 0.0 112.963 -177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -144.75 161.61 38.8 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.85 0.86 . . . . 0.0 110.581 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -9.23 8.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.559 2.744 . . . . 0.0 110.202 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.23 -31.93 69.51 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.903 1.281 . . . . 0.0 110.609 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -64.56 -35.59 81.48 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.396 0.998 . . . . 0.0 111.96 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.96 -43.14 72.15 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 30.8 tpp -64.88 -33.88 77.05 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.131 0.572 . . . . 0.0 111.174 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.42 -50.41 67.7 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.749 1.22 . . . . 0.0 109.949 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.9 t -60.17 -44.97 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.336 0.516 . . . . 0.0 110.097 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.93 -53.01 63.17 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.339 0.656 . . . . 0.0 110.091 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -60.39 -43.54 96.56 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.884 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.15 -45.9 92.76 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.257 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.0 tp -64.37 -49.35 71.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.999 0.818 . . . . 0.0 110.406 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -59.46 -46.62 88.27 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.47 0.176 . . . . 0.0 110.847 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -69.23 -38.44 78.51 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 118.813 -0.613 . . . . 0.0 111.03 -176.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.1 m -59.5 -50.96 71.9 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.799 0.84 . . . . 0.0 110.803 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt -54.91 -45.97 74.82 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -61.33 -37.38 83.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.791 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -68.82 -55.51 10.95 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 120.091 1.314 . . . . 0.0 109.432 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -74.16 -36.97 64.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.699 -169.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.6 tp -82.93 -28.76 29.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.887 0.767 . . . . 0.0 111.918 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 40.11 54.01 2.74 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.771 1.628 . . . . 0.0 112.831 -171.052 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -135.16 -179.51 5.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.89 2.076 . . . . 0.0 106.914 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.06 -1.49 12.39 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 177.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.313 11.9 m 48.47 38.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.161 2.184 . . . . 0.0 111.87 -174.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -66.21 171.26 4.87 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.259 1.023 . . . . 0.0 110.023 171.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -60.54 -37.74 82.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -62.04 -45.47 93.41 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.495 1.043 . . . . 0.0 110.003 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.78 -33.1 73.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.512 0.325 . . . . 0.0 111.125 -174.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.326 0.0 OUTLIER -81.16 -32.93 33.42 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.518 -1.364 . . . . 0.0 110.95 176.37 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.3 tp -60.95 -36.74 80.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.293 0.951 . . . . 0.0 111.22 169.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.12 -7.96 59.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.319 -0.863 . . . . 0.0 112.845 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.82 30.79 5.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.457 1.103 . . . . 0.0 112.702 175.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -41.07 -46.08 2.84 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.167 1.387 . . . . 0.0 112.667 174.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.98 -40.55 96.65 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.056 0.843 . . . . 0.0 111.451 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.8 -42.79 98.4 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.58 -49.56 75.97 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.414 1.086 . . . . 0.0 110.543 173.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -56.09 -47.25 78.36 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 118.693 0.679 . . . . 0.0 109.734 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.5 mt -67.74 -36.98 81.53 Favored 'General case' 0 CA--C 1.527 0.072 0 CA-C-O 118.859 -0.591 . . . . 0.0 111.121 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.55 -45.37 93.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.076 0.853 . . . . 0.0 110.054 175.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.07 -49.4 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 118.673 0.67 . . . . 0.0 109.348 176.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.49 -23.29 62.64 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.415 1.086 . . . . 0.0 113.05 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -97.21 -19.59 18.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.655 1.182 . . . . 0.0 111.809 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 61.2 mt -88.79 -40.86 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.394 0.997 . . . . 0.0 109.474 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.2 m -140.32 145.27 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.97 1.308 . . . . 0.0 109.539 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -144.61 134.32 23.57 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.625 1.57 . . . . 0.0 107.302 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.44 28.67 51.48 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.369 -0.684 . . . . 0.0 113.07 -176.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.09 15.98 81.12 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 118.23 1.015 . . . . 0.0 113.678 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 59.4 t -131.6 140.07 49.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 119.326 1.563 . . . . 0.0 107.517 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.0 pt -62.46 146.12 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.975 -0.453 . . . . 0.0 110.522 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.55 -5.39 3.29 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.739 0.815 . . . . 0.0 112.392 172.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -153.57 154.55 34.47 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 169.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.2 m -140.1 24.46 2.34 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.654 1.182 . . . . 0.0 110.856 -171.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -140.15 122.61 9.96 Favored Pre-proline 0 C--O 1.234 0.251 0 C-N-CA 124.476 1.11 . . . . 0.0 108.201 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.92 -30.45 16.89 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.379 2.053 . . . . 0.0 111.819 -169.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.28 -41.24 73.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 121.473 -0.767 . . . . 0.0 109.11 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.97 -39.48 87.22 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.676 0.671 . . . . 0.0 109.905 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.96 -55.59 11.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.57 -39.19 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.37 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -60.36 -46.55 89.56 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.513 1.051 . . . . 0.0 110.743 176.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -72.68 -31.79 65.31 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.862 1.21 . . . . 0.0 111.754 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.92 -41.49 89.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 119.393 0.997 . . . . 0.0 109.432 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.38 -35.78 71.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.033 0.533 . . . . 0.0 111.85 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.32 -25.97 59.88 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.889 0.875 . . . . 0.0 112.397 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.295 171.327 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.4 mmt . . . . . 0 N--CA 1.485 1.277 0 CA-C-O 120.739 0.304 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -63.89 -32.13 73.55 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.453 0.701 . . . . 0.0 111.669 177.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.74 160.1 43.81 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.796 1.638 . . . . 0.0 108.252 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 tp -54.19 -33.16 57.5 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.168 1.387 . . . . 0.0 112.481 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 pp -129.49 40.48 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.616 1.966 . . . . 0.0 109.53 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.09 -38.79 62.87 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 169.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -134.3 147.56 64.15 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 104.967 -2.235 . . . . 0.0 104.967 168.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -80.24 45.17 1.9 Allowed 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.788 2.992 . . . . 0.0 111.409 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.2 p -77.52 46.26 0.52 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.275 1.83 . . . . 0.0 111.912 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.52 172.17 14.41 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 127.126 2.17 . . . . 0.0 109.033 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.39 154.68 49.95 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.506 0.723 . . . . 0.0 110.903 -170.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 m -60.41 -34.28 73.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.505 1.122 . . . . 0.0 110.414 176.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.45 142.38 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -96.16 -41.7 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.412 1.085 . . . . 0.0 109.593 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.15 168.33 20.95 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.401 0.546 . . . . 0.0 111.642 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.9 137.08 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 127.292 2.237 . . . . 0.0 104.986 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 mt -133.89 151.26 51.45 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' CG2' HD11 ' A' ' 75' ' ' LEU . 62.6 mt -136.83 120.49 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 103.691 -2.707 . . . . 0.0 103.691 169.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.6 mt -123.68 148.84 46.14 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.733 0.813 . . . . 0.0 108.818 -169.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.68 172.25 3.6 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.685 0.755 . . . . 0.0 109.439 170.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.89 7.07 0.41 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.389 1.876 . . . . 0.0 114.054 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -131.66 11.0 4.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.873 1.669 . . . . 0.0 110.839 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.46 4.37 83.36 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.271 -0.893 . . . . 0.0 113.538 176.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -69.72 130.51 42.53 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.024 1.412 . . . . 0.0 110.197 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -67.14 105.5 1.71 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.397 1.079 . . . . 0.0 110.595 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.9 mt -81.55 -43.96 17.99 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 166.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -147.08 152.91 39.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.037 0.935 . . . . 0.0 109.741 174.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.11 149.98 19.88 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.045 0.938 . . . . 0.0 108.875 168.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -143.18 139.9 30.53 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 125.564 1.546 . . . . 0.0 106.941 169.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -127.27 150.11 49.71 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -129.29 -2.84 4.99 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -171.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -138.04 173.11 11.98 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.141 0.882 . . . . 0.0 110.921 -176.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -72.09 61.99 0.45 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.799 2.439 . . . . 0.0 109.044 174.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.6 m -154.31 91.99 1.47 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.638 -3.097 . . . . 0.0 102.638 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 55.43 60.9 8.91 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.377 1.471 . . . . 0.0 111.042 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -79.98 -2.73 12.3 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.5 2.133 . . . . 0.0 113.731 -175.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -136.22 141.88 44.01 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.379 0.99 . . . . 0.0 109.853 -169.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.2 t -43.92 -52.05 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 126.529 1.932 . . . . 0.0 113.326 -169.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -58.92 -42.72 90.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.527 0.603 . . . . 0.0 111.206 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.69 -32.39 63.91 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.678 0.391 . . . . 0.0 110.175 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -63.93 -48.83 74.98 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 123.232 0.613 . . . . 0.0 109.848 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -58.48 -35.74 72.66 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 118.754 0.706 . . . . 0.0 111.39 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.74 -48.74 70.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -63.3 -37.44 87.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.866 0.466 . . . . 0.0 111.189 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.7 -45.2 83.71 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.88 1.672 . . . . 0.0 111.004 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -60.8 -44.55 96.71 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.939 -0.475 . . . . 0.0 109.902 173.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.36 -46.51 79.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.251 0.62 . . . . 0.0 111.355 174.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.411 HD13 HD22 ' A' ' 62' ' ' LEU . 2.5 mm -57.59 -55.7 19.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 C-N-CA 124.468 1.107 . . . . 0.0 108.312 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -64.92 -41.04 95.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.982 0.356 . . . . 0.0 110.539 -175.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -59.42 -41.04 88.61 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.866 -0.521 . . . . 0.0 111.804 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -81.3 -45.71 15.8 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.22 0.463 . . . . 0.0 110.346 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.6 p -70.44 -26.89 63.86 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -169.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -74.2 -3.82 32.18 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.248 1.385 . . . . 0.0 112.091 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.3 mtt-85 -113.58 16.39 18.71 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 110.075 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -131.89 157.64 43.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.108 1.363 . . . . 0.0 108.599 -169.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.01 85.55 4.23 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.477 1.111 . . . . 0.0 109.67 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.5 m -47.07 136.85 8.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.051 1.74 . . . . 0.0 115.509 -169.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.06 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.454 1 C-N-CA 132.906 4.482 . . . . 0.0 107.433 173.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.29 156.82 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.561 1.544 . . . . 0.0 108.485 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.36 171.02 18.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.752 2.021 . . . . 0.0 108.721 174.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.8 tp -133.45 114.31 13.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.411 HD22 HD13 ' A' ' 48' ' ' ILE . 10.9 mp -114.24 98.82 7.17 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -174.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 57.72 14.33 2.39 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.224 1.81 . . . . 0.0 114.193 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.43 -31.2 2.9 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.683 1.611 . . . . 0.0 111.768 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.7 mt -83.28 129.94 35.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.433 1.116 . . . . 0.0 109.208 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -74.76 141.66 44.39 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 171.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 97.5 t -137.54 131.51 44.06 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.093 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.5 m -118.38 144.75 25.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 169.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -162.18 164.3 27.9 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 111.803 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -150.04 175.01 12.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.024 0.93 . . . . 0.0 108.594 169.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.3 p -139.61 145.35 38.43 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -145.69 137.9 25.52 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 11.8 mt 64.77 -82.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.21 1.804 . . . . 0.0 110.896 170.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -152.9 28.8 0.52 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.392 1.877 . . . . 0.0 108.934 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.473 HD11 ' CG2' ' A' ' 18' ' ' ILE . 47.6 tp -139.4 146.3 39.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 125.984 1.714 . . . . 0.0 109.428 -168.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -126.07 145.97 50.11 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.142 1.377 . . . . 0.0 107.482 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -136.21 138.07 41.5 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 -170.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -145.85 149.3 34.03 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.875 0.87 . . . . 0.0 111.359 -170.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.8 t -138.15 138.62 43.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 169.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.08 139.25 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -172.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -156.81 177.7 33.6 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-O 122.118 0.843 . . . . 0.0 112.594 -173.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.4 m -59.54 162.24 5.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.678 1.591 . . . . 0.0 112.452 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -71.84 27.46 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.698 1.999 . . . . 0.0 112.207 171.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -71.78 173.46 8.17 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.384 1.073 . . . . 0.0 112.142 -169.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.38 -7.59 38.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.74 1.616 . . . . 0.0 113.328 -172.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -141.8 159.87 41.33 Favored 'General case' 0 C--N 1.339 0.126 0 CA-C-N 119.061 0.846 . . . . 0.0 110.36 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.49 -6.57 10.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.322 2.249 . . . . 0.0 110.317 173.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -36.36 71.81 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.961 1.304 . . . . 0.0 111.099 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -65.86 -33.95 77.02 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.871 0.76 . . . . 0.0 111.675 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 34.3 mt -73.53 -42.48 61.69 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.0 mmt -56.64 -40.17 74.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.011 0.524 . . . . 0.0 110.06 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.89 -49.33 73.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.546 0.738 . . . . 0.0 109.887 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.0 t -60.14 -45.53 95.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 118.118 0.417 . . . . 0.0 110.166 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.5 tp -60.02 -49.29 78.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 122.903 0.481 . . . . 0.0 110.366 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.26 -42.02 96.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.846 -0.597 . . . . 0.0 110.594 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.2 m -60.11 -48.51 81.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.896 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 44.8 tp -64.86 -46.47 81.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.566 1.075 . . . . 0.0 111.155 -176.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.29 -46.88 88.31 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 122.999 0.52 . . . . 0.0 110.916 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.26 -26.4 52.45 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.33 -0.856 . . . . 0.0 111.641 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.7 m -62.98 -50.29 71.37 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.134 0.879 . . . . 0.0 110.313 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.2 mt -52.0 -47.75 64.79 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -58.92 -25.57 63.57 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.706 -1.14 . . . . 0.0 113.909 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -85.58 -53.5 5.13 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 121.041 1.746 . . . . 0.0 110.951 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -75.18 -38.11 60.98 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.598 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 tp -82.0 -39.1 24.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.959 0.504 . . . . 0.0 110.062 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.272 26.0 ptt-85 39.05 53.02 2.08 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.162 1.785 . . . . 0.0 112.237 -178.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -131.96 -169.82 2.28 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 128.215 2.606 . . . . 0.0 105.703 169.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -72.48 7.3 1.9 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.296 16.8 m 44.76 41.05 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.914 2.086 . . . . 0.0 112.164 -171.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -73.5 160.31 31.89 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.262 1.025 . . . . 0.0 109.485 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 33.4 pttt -60.37 -32.49 71.35 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -172.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -37.44 75.05 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.761 0.424 . . . . 0.0 110.258 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.74 -34.83 72.29 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.319 173.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -60.42 -45.38 93.82 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.962 -1.086 . . . . 0.0 110.441 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.79 -39.34 73.92 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.66 0.784 . . . . 0.0 111.094 175.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -63.66 -25.61 68.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.09 27.38 5.4 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 118.787 0.721 . . . . 0.0 112.689 -171.491 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -40.7 -48.82 3.02 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 125.074 1.349 . . . . 0.0 112.247 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.41 -40.29 96.8 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.819 0.736 . . . . 0.0 111.722 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.17 -44.33 97.87 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.79 -50.0 75.57 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.464 1.105 . . . . 0.0 110.322 175.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -54.91 -48.78 72.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.667 0.667 . . . . 0.0 109.897 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.91 -37.52 84.51 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.181 0.592 . . . . 0.0 111.194 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.81 90.38 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.655 0.661 . . . . 0.0 109.867 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.3 t -57.31 -44.38 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.564 0.62 . . . . 0.0 109.529 175.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -71.66 1.48 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.133 0.973 . . . . 0.0 113.433 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -118.28 -12.03 9.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.666 1.586 . . . . 0.0 111.34 172.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.6 mt -88.06 -40.57 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 24.0 t -133.69 145.61 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.319 1.048 . . . . 0.0 110.513 -169.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -144.87 130.7 19.16 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 125.846 1.658 . . . . 0.0 106.898 168.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.78 29.61 55.0 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 119.398 -0.668 . . . . 0.0 113.868 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.65 16.22 80.43 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.288 1.044 . . . . 0.0 113.289 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.5 t -127.91 138.45 54.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.9 pt -66.2 147.06 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.6 pp -128.03 -11.69 5.3 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.246 1.018 . . . . 0.0 111.692 177.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -147.79 157.22 43.43 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 169.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 7.3 m -141.83 26.64 1.88 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.996 0.918 . . . . 0.0 110.862 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -141.97 128.76 11.24 Favored Pre-proline 0 C--O 1.236 0.346 0 C-N-CA 124.084 0.953 . . . . 0.0 108.501 177.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.48 -38.55 8.24 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.846 2.364 . . . . 0.0 113.67 -172.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.281 0.0 OUTLIER -76.36 -26.98 56.25 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.873 -1.142 . . . . 0.0 110.162 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 -66.18 -44.33 84.32 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.537 1.062 . . . . 0.0 109.618 169.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.4 t -54.88 -51.64 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 118.926 0.785 . . . . 0.0 109.541 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.39 -38.22 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.05 0.841 . . . . 0.0 110.693 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -62.92 -38.85 92.62 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.674 1.125 . . . . 0.0 110.947 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 25.2 mtt-85 -64.01 -46.73 83.21 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.925 0.784 . . . . 0.0 109.998 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.7 t -58.34 -41.41 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.95 -33.95 74.54 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.553 0.741 . . . . 0.0 111.994 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 29.9 mt -72.34 -32.15 66.25 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.042 0.937 . . . . 0.0 111.983 177.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.332 -0.842 . . . . 0.0 109.998 176.647 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.1 -26.91 62.33 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.145 0.884 . . . . 0.0 112.231 -172.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 30.36 -90.6 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 129.19 2.996 . . . . 0.0 114.736 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.89 -33.83 62.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.589 1.155 . . . . 0.0 112.169 -176.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.6 mm -123.21 36.49 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 125.534 1.534 . . . . 0.0 108.08 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.98 -31.2 68.55 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.124 -0.985 . . . . 0.0 110.116 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -136.67 155.07 76.93 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 127.05 2.14 . . . . 0.0 106.0 169.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -64.99 145.86 86.32 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.903 1.736 . . . . 0.0 109.763 174.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -61.5 -29.3 69.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.011 0.924 . . . . 0.0 112.966 -171.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.22 178.6 9.57 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.39 1.876 . . . . 0.0 108.595 174.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -50.77 132.01 26.19 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.202 1.001 . . . . 0.0 112.679 -170.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 m -63.15 -38.59 91.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.312 1.845 . . . . 0.0 110.637 175.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.7 m -141.66 153.39 19.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 124.644 1.178 . . . . 0.0 108.036 175.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -111.75 -28.7 7.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 117.206 -1.378 . . . . 0.0 110.688 174.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.14 166.66 25.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.14 1.336 . . . . 0.0 112.38 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.4 mt -136.21 136.67 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mt -135.41 154.02 51.6 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.048 0.939 . . . . 0.0 108.682 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.9 mt -138.83 123.87 21.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 169.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.5 mt -129.15 149.07 51.11 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -171.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -65.61 172.68 3.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.548 170.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -74.4 30.05 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.906 2.083 . . . . 0.0 111.878 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -147.98 7.66 0.83 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.278 2.231 . . . . 0.0 110.79 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.54 10.06 86.51 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 121.001 -1.062 . . . . 0.0 113.105 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -72.35 129.68 38.97 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 118.751 1.276 . . . . 0.0 109.949 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.74 106.84 0.73 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 125.315 1.446 . . . . 0.0 109.996 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.6 -44.41 8.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 166.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -147.29 151.5 36.72 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.754 0.822 . . . . 0.0 109.531 172.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.89 145.12 15.27 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 169.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -146.98 146.85 30.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.939 1.295 . . . . 0.0 108.181 174.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -135.23 149.64 49.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.259 1.424 . . . . 0.0 107.704 -174.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -132.62 0.34 3.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.674 1.19 . . . . 0.0 111.612 -174.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -131.9 160.63 35.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.845 0.858 . . . . 0.0 108.796 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.26 6.12 3.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.595 1.958 . . . . 0.0 112.897 -170.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 p -61.99 -48.63 79.47 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.823 1.249 . . . . 0.0 110.735 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -144.84 73.48 14.97 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.233 1.013 . . . . 0.0 109.212 -175.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -85.01 -2.51 9.59 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.459 2.106 . . . . 0.0 113.956 -173.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -137.65 140.73 41.01 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.368 0.985 . . . . 0.0 110.054 -169.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.23 -43.95 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.14 1.376 . . . . 0.0 113.229 -169.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -59.26 -38.29 79.71 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 117.799 0.272 . . . . 0.0 111.428 -176.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -85.84 -32.51 21.69 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.012 0.369 . . . . 0.0 110.236 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.6 -51.88 66.71 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 123.269 0.628 . . . . 0.0 110.201 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -60.41 -31.67 70.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.546 -0.721 . . . . 0.0 111.348 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.81 -48.13 67.13 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -61.51 -36.55 80.84 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.031 0.532 . . . . 0.0 111.055 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -66.83 -44.08 82.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.602 1.561 . . . . 0.0 111.311 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -60.71 -44.11 97.0 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.677 -0.639 . . . . 0.0 110.014 172.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.66 -45.95 81.37 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.599 0.76 . . . . 0.0 111.224 174.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.62 -53.35 45.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 C-N-CA 124.259 1.024 . . . . 0.0 108.474 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -62.5 -46.05 90.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.477 0.58 . . . . 0.0 110.362 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 -56.09 -42.45 76.76 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.997 0.919 . . . . 0.0 111.915 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -78.69 -47.83 16.17 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.171 0.589 . . . . 0.0 110.156 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.0 p -66.88 -30.38 70.52 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.54 -0.725 . . . . 0.0 111.851 -175.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -59.71 -20.72 58.24 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.363 -0.835 . . . . 0.0 112.23 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -108.58 17.63 21.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.842 1.657 . . . . 0.0 110.433 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 56.4 m -121.61 163.33 19.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.89 1.276 . . . . 0.0 108.942 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -95.63 25.5 4.52 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.076 1.75 . . . . 0.0 113.333 -169.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.0 m 73.82 176.88 0.24 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.315 1.846 . . . . 0.0 113.227 172.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.319 10.5 pt-20 56.33 -43.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 131.072 3.749 . . . . 0.0 116.354 -173.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -148.11 155.85 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 120.303 1.411 . . . . 0.0 109.766 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.85 167.03 27.74 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.248 2.219 . . . . 0.0 108.133 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 tp -135.08 116.07 14.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mp -117.35 97.29 5.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -172.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 57.45 15.92 2.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.225 1.81 . . . . 0.0 114.082 171.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.99 -28.36 3.91 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.7 1.619 . . . . 0.0 111.971 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.3 mt -82.26 128.27 34.02 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.474 1.137 . . . . 0.0 109.178 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.8 m -75.88 138.24 40.94 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 172.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.9 t -136.9 133.48 48.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.8 m -118.87 146.85 22.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 169.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -158.16 162.77 37.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.166 0.508 . . . . 0.0 110.981 -175.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -148.16 174.76 11.64 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.236 1.014 . . . . 0.0 108.418 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -139.76 146.58 39.69 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 169.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.1 m -142.45 137.66 30.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.89 0.876 . . . . 0.0 108.691 177.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.8 mt 63.17 -76.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 127.26 2.224 . . . . 0.0 110.805 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -156.37 31.35 0.33 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.719 1.608 . . . . 0.0 109.999 176.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.1 tp -140.17 149.46 43.0 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.293 1.437 . . . . 0.0 109.421 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -124.19 149.97 45.75 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.537 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -139.77 142.91 36.72 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.369 1.468 . . . . 0.0 107.862 -172.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -147.44 152.43 38.08 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.666 0.786 . . . . 0.0 111.189 -170.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.7 t -138.9 140.14 39.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 169.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.47 140.56 48.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.54 -179.86 34.64 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-O 122.664 1.147 . . . . 0.0 112.074 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.4 m -64.69 164.74 11.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.735 1.614 . . . . 0.0 112.557 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.2 p -74.02 37.93 0.1 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.997 2.119 . . . . 0.0 111.377 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -68.03 169.4 10.15 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.577 1.151 . . . . 0.0 110.819 -175.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.48 -4.18 21.51 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.651 1.18 . . . . 0.0 113.558 -174.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -149.35 172.63 14.6 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.368 1.467 . . . . 0.0 108.786 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.38 -1.98 3.51 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.055 2.542 . . . . 0.0 110.256 -176.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -64.49 -30.9 71.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.737 1.215 . . . . 0.0 110.51 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -35.06 79.28 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.263 0.938 . . . . 0.0 111.497 172.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -69.37 -46.41 67.02 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.1 mmt -55.25 -41.35 72.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.39 174.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.13 -50.08 71.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.005 0.922 . . . . 0.0 110.038 -179.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.33 -43.77 97.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.217 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.2 tp -60.89 -48.9 79.69 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 118.482 0.583 . . . . 0.0 110.486 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -63.67 -44.11 94.73 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.351 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 92.5 m -60.35 -47.06 87.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.147 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.6 tp -64.86 -49.12 71.78 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 119.057 0.844 . . . . 0.0 110.787 -177.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.59 -42.36 98.75 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.175 0.443 . . . . 0.0 110.927 -177.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -73.14 -36.63 66.71 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.49 -0.756 . . . . 0.0 111.173 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 20.8 m -63.76 -43.34 96.71 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.971 0.805 . . . . 0.0 110.85 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.8 mt -53.7 -50.35 66.07 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.9 m -57.18 -38.69 73.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.368 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.6 -49.54 66.0 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.35 -0.833 . . . . 0.0 111.54 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 4.2 ptp -69.99 -34.98 74.03 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.379 0.99 . . . . 0.0 111.211 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.43 -43.14 64.26 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.868 0.467 . . . . 0.0 111.024 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 51.96 27.21 4.2 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.065 1.346 . . . . 0.0 112.437 -169.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -156.59 -175.62 5.53 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.177 2.191 . . . . 0.0 107.676 177.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -46.85 123.45 5.18 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.992 1.317 . . . . 0.0 110.233 174.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 17.2 m -84.91 51.05 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.993 1.317 . . . . 0.0 108.974 171.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.11 178.21 7.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.364 1.066 . . . . 0.0 111.652 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -47.73 -54.28 12.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.65 1.18 . . . . 0.0 112.718 -175.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -65.04 -41.37 95.28 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.313 0.506 . . . . 0.0 109.733 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.83 76.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.151 0.581 . . . . 0.0 111.97 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -69.54 -49.56 53.21 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 123.984 0.914 . . . . 0.0 110.253 171.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.6 tp -56.33 -37.41 69.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.808 0.843 . . . . 0.0 111.263 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -81.98 -3.31 54.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.543 0.737 . . . . 0.0 112.339 -178.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -132.91 22.43 4.19 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.786 1.235 . . . . 0.0 112.209 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -43.4 21.36 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.207 1.003 . . . . 0.0 111.724 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.26 -42.88 92.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.853 0.752 . . . . 0.0 111.466 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.14 -41.49 99.7 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 177.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.16 -48.92 78.79 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.559 1.144 . . . . 0.0 110.672 173.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.09 -45.52 83.29 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 118.808 0.731 . . . . 0.0 109.683 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.68 -35.38 78.73 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.164 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.25 89.7 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 119.081 0.855 . . . . 0.0 110.145 175.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.1 t -57.52 -47.74 84.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.11 -21.73 63.99 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.487 1.115 . . . . 0.0 113.158 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -97.64 -22.8 16.28 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.277 1.031 . . . . 0.0 111.562 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 67.4 mt -83.13 -45.29 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.3 0.954 . . . . 0.0 108.976 177.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 m -139.89 153.26 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.413 1.085 . . . . 0.0 110.684 -171.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -149.32 140.69 23.24 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.347 1.459 . . . . 0.0 107.85 169.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.45 28.01 54.84 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.464 -0.631 . . . . 0.0 113.463 177.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.68 17.79 79.57 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.194 0.997 . . . . 0.0 113.41 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 56.4 t -132.41 142.08 43.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 119.07 1.435 . . . . 0.0 107.383 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.6 pt -65.18 151.21 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 O-C-N 121.976 -0.452 . . . . 0.0 110.284 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 pp -134.32 -10.58 2.52 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.867 0.867 . . . . 0.0 111.939 170.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -149.01 155.61 41.04 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.3 m -140.31 23.56 2.35 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.241 1.417 . . . . 0.0 110.878 -170.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -140.46 125.1 10.91 Favored Pre-proline 0 C--O 1.236 0.356 0 C-N-CA 124.208 1.003 . . . . 0.0 108.865 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.88 -34.31 5.4 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.322 2.015 . . . . 0.0 113.924 -169.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.308 2.3 pp0? -76.11 -27.3 57.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.945 -1.097 . . . . 0.0 110.304 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -67.54 -45.29 76.1 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.357 0.98 . . . . 0.0 109.501 169.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.5 t -54.21 -56.52 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.58 -33.47 63.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.237 0.926 . . . . 0.0 110.656 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -50.31 74.24 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.334 0.97 . . . . 0.0 109.824 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -69.07 -30.92 69.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.996 1.271 . . . . 0.0 112.462 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.65 -43.92 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.661 1.119 . . . . 0.0 109.742 171.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.66 -31.08 66.43 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.095 0.558 . . . . 0.0 111.884 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.6 tp -68.76 -33.96 74.78 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 125.696 1.598 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 63.5 mtt85 . . . . . 0 C--O 1.249 1.052 0 O-C-N 123.383 0.427 . . . . 0.0 110.405 173.547 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 tpt . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -63.92 -42.72 97.31 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.066 0.547 . . . . 0.0 111.406 -172.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.06 150.02 26.79 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.733 1.613 . . . . 0.0 106.949 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -65.58 -8.91 22.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.6 mt -130.0 38.26 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.766 1.226 . . . . 0.0 108.859 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.9 tp -57.34 -31.65 65.93 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.53 169.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -127.69 151.37 75.23 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.951 2.1 . . . . 0.0 105.407 169.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -62.4 132.17 37.2 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.788 2.326 . . . . 0.0 110.692 -171.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.6 p -70.13 -24.17 63.13 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.854 1.262 . . . . 0.0 112.402 -174.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -152.55 -179.83 7.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.513 1.925 . . . . 0.0 108.785 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -45.45 126.15 6.32 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.672 1.589 . . . . 0.0 111.69 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 p -69.01 -37.52 78.73 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.4 m -139.82 157.56 26.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 174.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -121.94 -28.83 4.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.589 1.155 . . . . 0.0 111.058 -172.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -158.04 163.94 37.21 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.704 1.138 . . . . 0.0 110.689 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.8 mt -135.06 135.16 52.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.2 mt -133.91 149.31 51.29 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.92 116.72 14.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 103.592 -2.744 . . . . 0.0 103.592 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.8 mt -124.44 145.38 49.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.08 169.03 7.45 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.304 0.574 . . . . 0.0 110.305 169.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -13.77 1.93 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -178.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -112.99 5.9 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.649 1.18 . . . . 0.0 110.844 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.99 7.27 59.85 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 125.021 1.296 . . . . 0.0 112.666 173.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.44 131.69 45.16 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 119.252 1.526 . . . . 0.0 109.738 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -58.21 127.49 32.37 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.9 mt -107.84 -40.16 5.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 161.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -148.08 153.11 38.46 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 123.382 0.673 . . . . 0.0 109.713 170.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.5 145.9 19.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.208 1.003 . . . . 0.0 108.449 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -144.98 139.15 27.3 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.873 1.669 . . . . 0.0 106.77 176.913 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -128.63 151.02 49.96 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.928 1.291 . . . . 0.0 108.18 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -134.04 22.3 3.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.698 1.999 . . . . 0.0 108.4 174.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.72 147.98 48.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.652 1.581 . . . . 0.0 111.39 -168.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -96.73 -6.87 35.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.521 1.528 . . . . 0.0 111.953 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.5 m -70.68 -38.22 73.72 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.31 -0.869 . . . . 0.0 109.649 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -136.41 67.59 60.32 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 125.029 1.332 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -87.77 -1.33 7.34 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.768 2.312 . . . . 0.0 113.645 -176.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.8 m -135.23 141.0 45.71 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.065 0.848 . . . . 0.0 110.22 -169.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -46.03 -50.03 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.422 1.889 . . . . 0.0 112.736 -169.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -55.83 -47.29 77.46 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.144 0.429 . . . . 0.0 111.304 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -79.27 -32.42 43.67 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -177.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.34 -50.83 72.04 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 123.439 0.696 . . . . 0.0 110.624 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -62.7 -31.84 72.82 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.972 0.806 . . . . 0.0 111.132 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.95 72.15 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.914 -0.491 . . . . 0.0 110.007 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.91 -42.96 99.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.24 0.616 . . . . 0.0 110.223 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.14 -42.7 91.28 Favored 'General case' 0 C--N 1.334 -0.092 0 C-N-CA 126.562 1.945 . . . . 0.0 112.063 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -59.72 -43.32 94.22 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 118.996 0.816 . . . . 0.0 109.594 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -45.01 91.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 118.055 -0.974 . . . . 0.0 111.627 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.25 -55.55 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -58.61 -45.51 89.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.897 0.879 . . . . 0.0 110.702 -174.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -54.57 -45.52 73.54 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.267 1.027 . . . . 0.0 111.453 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 62' ' ' LEU . 15.7 mmmt -70.83 -49.58 44.82 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 119.065 -0.493 . . . . 0.0 110.348 -179.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 37.2 p -67.62 -31.3 71.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.54 1.064 . . . . 0.0 111.398 -173.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -59.27 -23.89 62.77 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.606 0.762 . . . . 0.0 111.304 172.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -120.71 36.06 4.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.315 1.446 . . . . 0.0 109.797 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.9 m -127.98 158.17 38.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.822 1.649 . . . . 0.0 106.581 170.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.75 -59.61 3.41 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.741 -0.6 . . . . 0.0 111.037 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m 177.57 -169.47 0.08 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.73 3.212 . . . . 0.0 107.286 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.322 10.4 pt-20 60.8 -47.91 0.11 Allowed 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 131.203 3.801 . . . . 0.0 117.196 169.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -158.41 152.72 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 121.024 1.738 . . . . 0.0 110.915 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.63 173.89 11.13 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.57 1.948 . . . . 0.0 108.775 170.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.3 tp -137.09 115.05 11.46 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.077 -2.194 . . . . 0.0 105.077 -176.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.406 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 1.5 mm? -75.62 -72.82 0.29 Allowed 'General case' 0 N--CA 1.457 -0.094 0 O-C-N 123.264 0.353 . . . . 0.0 110.138 -172.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -144.97 6.39 1.17 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.343 1.857 . . . . 0.0 110.881 -175.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 149.02 -40.27 0.9 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 126.086 1.803 . . . . 0.0 108.98 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.2 mt -68.61 142.93 55.0 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.9 m -107.86 146.44 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.9 p -139.67 118.77 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.3 m -86.41 150.05 3.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 106.282 -1.748 . . . . 0.0 106.282 169.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -153.73 166.09 33.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.582 0.706 . . . . 0.0 111.39 175.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.506 ' HE3' ' CE1' ' A' ' 98' ' ' PHE . 37.6 tttp -152.17 156.93 40.77 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.896 1.679 . . . . 0.0 106.758 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -136.13 135.53 39.33 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m -142.07 142.74 32.86 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.626 0.77 . . . . 0.0 109.382 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 mp 53.71 -85.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.156 2.182 . . . . 0.0 111.898 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -150.14 31.93 0.68 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.41 1.884 . . . . 0.0 108.806 -176.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.7 tp -140.38 145.21 36.81 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.494 1.918 . . . . 0.0 108.571 -169.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -127.79 140.25 52.16 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.679 1.192 . . . . 0.0 107.803 -179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -123.68 141.48 51.98 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.675 1.59 . . . . 0.0 107.47 -176.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -146.9 152.31 38.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 119.013 0.824 . . . . 0.0 110.524 -175.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 63.5 t -141.06 122.61 14.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 105.801 -1.925 . . . . 0.0 105.801 169.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -99.19 142.11 15.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.64 174.82 38.21 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-O 121.892 0.718 . . . . 0.0 112.4 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.31 176.5 3.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.148 1.379 . . . . 0.0 109.74 173.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.0 p -152.34 72.9 1.01 Allowed 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.377 -0.827 . . . . 0.0 109.383 172.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -54.94 -43.98 73.88 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.553 0.741 . . . . 0.0 111.037 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -145.17 -12.58 0.54 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.781 1.232 . . . . 0.0 112.173 172.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -156.52 175.69 13.7 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.565 1.146 . . . . 0.0 109.89 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.56 4.36 4.64 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.872 2.469 . . . . 0.0 110.585 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.2 -32.35 73.73 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 120.869 -1.144 . . . . 0.0 110.663 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -32.46 72.31 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.999 0.818 . . . . 0.0 111.682 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.89 -50.05 68.07 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 172.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.3 mmt -55.64 -41.24 73.28 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.538 0.335 . . . . 0.0 110.295 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.14 75.72 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.587 0.755 . . . . 0.0 110.287 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.91 -44.78 98.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 119.027 0.83 . . . . 0.0 110.07 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.82 -50.76 72.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.344 0.52 . . . . 0.0 110.616 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -64.24 -40.29 95.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 119.581 -0.247 . . . . 0.0 110.484 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.07 -45.56 93.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.474 0.71 . . . . 0.0 109.574 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 tp -65.08 -49.63 69.3 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.786 0.721 . . . . 0.0 111.114 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.506 ' CE1' ' HE3' ' A' ' 70' ' ' LYS . 68.5 t80 -60.93 -43.81 98.11 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.376 0.608 . . . . 0.0 110.88 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.59 -28.81 37.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.322 -0.861 . . . . 0.0 111.969 -174.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 23.3 p -66.72 -45.88 77.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 119.905 1.23 . . . . 0.0 110.01 172.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.1 mt -51.13 -49.43 60.81 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 m -58.85 -32.32 69.33 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.159 -0.924 . . . . 0.0 113.262 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -76.36 -50.64 13.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 120.603 1.547 . . . . 0.0 110.659 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -79.78 -32.21 40.88 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 119.357 -0.937 . . . . 0.0 112.95 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.503 HD21 ' HB1' ' A' ' 113' ' ' ALA . 18.3 tp -82.37 -32.54 29.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 118.058 0.39 . . . . 0.0 111.9 -170.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 46.36 47.79 13.69 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.083 1.353 . . . . 0.0 112.275 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -138.08 174.97 10.0 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.928 2.091 . . . . 0.0 105.903 169.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -72.25 15.32 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -178.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.28 24.0 m 44.06 41.7 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 127.148 2.179 . . . . 0.0 111.734 -173.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.6 170.57 15.51 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.205 1.002 . . . . 0.0 110.841 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -53.96 -42.09 68.52 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.476 0.71 . . . . 0.0 112.798 -176.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.7 tpp85 -66.57 -42.17 87.44 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-O 118.887 -0.578 . . . . 0.0 110.073 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.503 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -64.38 -39.03 93.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.899 0.772 . . . . 0.0 110.388 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.03 -50.97 71.6 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.614 0.766 . . . . 0.0 110.089 171.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.9 tp -58.0 -37.88 75.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.51 0.724 . . . . 0.0 111.684 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -67.61 -21.88 65.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.838 0.855 . . . . 0.0 112.864 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.43 24.6 4.8 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.259 0.936 . . . . 0.0 113.12 -171.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -45.33 3.44 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.197 1.399 . . . . 0.0 112.351 177.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -66.24 -38.2 87.33 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.427 1.012 . . . . 0.0 112.275 -178.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.84 -40.55 93.68 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 175.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.27 -48.91 77.67 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.139 0.976 . . . . 0.0 110.242 170.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -57.74 -46.56 84.29 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.9 mt -65.62 -38.88 90.68 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.472 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.97 -48.73 79.07 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-N 119.039 0.836 . . . . 0.0 109.631 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.0 t -56.72 -46.78 83.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.6 . . . . 0.0 109.458 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -68.71 -0.53 5.42 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.273 1.429 . . . . 0.0 113.56 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -120.64 -15.65 8.41 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.534 1.533 . . . . 0.0 111.34 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 65.7 mt -82.36 -37.04 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.306 1.043 . . . . 0.0 109.009 169.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.07 153.51 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.27 0.941 . . . . 0.0 110.384 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -150.54 136.94 18.76 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.307 1.443 . . . . 0.0 107.248 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.75 29.74 50.41 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.488 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.46 18.34 79.34 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-N 118.067 0.933 . . . . 0.0 113.7 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 41.4 t -126.47 133.03 69.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 174.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.5 pt -60.2 156.87 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.74 0.781 . . . . 0.0 111.422 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.0 mt -120.23 -22.24 6.66 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.291 1.836 . . . . 0.0 110.271 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -154.85 160.61 41.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.036 0.835 . . . . 0.0 109.973 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 m -135.52 14.04 3.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.998 1.319 . . . . 0.0 112.205 -169.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.79 123.29 10.61 Favored Pre-proline 0 N--CA 1.465 0.277 0 C-N-CA 123.72 0.808 . . . . 0.0 110.09 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.7 -44.63 13.12 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.728 2.286 . . . . 0.0 112.941 -170.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pp0? -73.92 -26.94 60.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 119.292 -0.963 . . . . 0.0 111.07 -175.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.05 -35.2 74.08 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.547 1.521 . . . . 0.0 110.539 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.7 -43.27 87.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 119.575 1.079 . . . . 0.0 109.24 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.43 -39.47 84.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.844 1.202 . . . . 0.0 111.028 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -61.04 -45.5 94.51 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.904 1.229 . . . . 0.0 110.155 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -59.04 -47.79 83.96 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.855 -0.528 . . . . 0.0 110.017 177.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 62.6 t -59.5 -41.93 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.496 0.718 . . . . 0.0 109.912 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.05 -34.86 77.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.186 0.595 . . . . 0.0 111.782 -178.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.33 -32.32 58.63 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.944 0.898 . . . . 0.0 111.929 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.838 178.834 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.483 1.206 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -139.51 171.09 14.76 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.233 1.413 . . . . 0.0 108.031 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.15 164.08 37.34 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.196 1.398 . . . . 0.0 108.977 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.8 tp -59.15 -33.21 70.63 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.882 0.873 . . . . 0.0 111.722 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 12.4 mt -131.55 56.43 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.78 132.84 55.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.507 0.723 . . . . 0.0 109.168 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 20.83 69.12 0.27 Allowed Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 129.066 2.946 . . . . 0.0 114.565 174.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.66 162.13 42.09 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.417 2.745 . . . . 0.0 111.167 -177.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.2 m -74.78 20.38 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.05 1.34 . . . . 0.0 112.232 171.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.43 133.74 47.15 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.845 1.258 . . . . 0.0 108.909 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -125.63 131.42 52.66 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 m -54.06 -40.34 67.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.532 1.133 . . . . 0.0 111.267 -176.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.3 m -140.5 164.29 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.413 1.085 . . . . 0.0 108.692 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -122.8 -28.98 4.06 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 125.001 1.32 . . . . 0.0 110.191 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.75 166.9 27.9 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.753 1.16 . . . . 0.0 111.867 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -136.61 136.31 48.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -132.44 149.29 52.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 61.8 mt -139.1 120.39 15.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 104.175 -2.528 . . . . 0.0 104.175 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.8 mt -127.76 149.24 50.33 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.38 171.19 4.09 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -17.06 62.42 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.795 0.838 . . . . 0.0 112.354 173.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.5 -9.48 59.4 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.298 1.039 . . . . 0.0 112.095 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.44 86.01 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 0.0 112.274 -171.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -74.56 143.22 44.57 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.461 1.131 . . . . 0.0 109.941 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -59.61 133.02 55.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.626 0.648 . . . . 0.0 110.21 177.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt -106.31 -38.6 6.18 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 151.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.63 154.33 36.2 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.792 0.837 . . . . 0.0 110.632 172.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 146.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.433 1.093 . . . . 0.0 108.585 169.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.99 144.26 30.94 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 125.699 1.6 . . . . 0.0 107.505 171.212 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -128.81 150.47 50.3 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.554 1.542 . . . . 0.0 107.513 176.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -135.14 -0.86 2.7 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.816 0.846 . . . . 0.0 111.984 -174.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -135.02 160.2 39.07 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.885 0.766 . . . . 0.0 110.125 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -72.06 3.39 4.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.71 2.004 . . . . 0.0 113.194 -170.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -62.45 -49.04 77.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.414 1.085 . . . . 0.0 110.752 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -142.86 69.3 19.09 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.222 1.009 . . . . 0.0 109.537 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -85.74 -2.37 9.0 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.698 2.265 . . . . 0.0 113.627 -173.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.1 m -135.9 141.92 44.63 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 119.278 0.945 . . . . 0.0 109.617 -169.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.4 t -44.52 -52.82 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 126.469 1.908 . . . . 0.0 113.137 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -60.32 -45.0 94.96 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.624 0.647 . . . . 0.0 111.014 -175.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -69.98 -34.12 72.95 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -62.66 -51.5 67.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 118.625 -0.702 . . . . 0.0 109.857 174.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.97 -38.03 75.28 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.275 0.943 . . . . 0.0 111.496 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.17 -50.09 73.23 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.213 0.605 . . . . 0.0 109.609 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.52 -38.65 91.95 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.454 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.0 -45.09 96.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 126.444 1.898 . . . . 0.0 111.473 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.23 -40.03 93.52 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 121.546 -0.721 . . . . 0.0 110.035 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.476 HD21 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -57.03 -49.55 75.47 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.669 -0.681 . . . . 0.0 111.062 171.182 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -54.85 -50.71 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 124.703 1.201 . . . . 0.0 108.71 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -61.17 -49.32 77.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.67 0.388 . . . . 0.0 110.318 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -57.4 -49.37 76.41 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.893 0.477 . . . . 0.0 111.1 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm -60.46 -52.44 65.21 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.0 p -71.87 -32.16 67.19 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.903 -0.498 . . . . 0.0 111.885 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -63.12 -15.12 55.69 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.515 -0.74 . . . . 0.0 111.443 171.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -120.85 25.52 9.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.185 1.794 . . . . 0.0 109.837 -176.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 94.8 m -131.42 158.1 41.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.169 1.788 . . . . 0.0 107.711 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.18 -42.11 99.32 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 118.442 -0.79 . . . . 0.0 112.879 -170.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m 139.8 -177.71 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.805 1 C-N-CA 132.427 4.291 . . . . 0.0 108.878 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.324 10.2 pt-20 59.07 -44.03 0.07 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 131.226 3.81 . . . . 0.0 117.307 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.0 tt -150.23 155.48 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 120.61 1.55 . . . . 0.0 109.932 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.79 166.06 30.58 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.034 2.134 . . . . 0.0 108.541 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.66 115.71 14.96 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 104.331 -2.47 . . . . 0.0 104.331 171.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.476 HD13 HD21 ' A' ' 47' ' ' ASN . 1.5 pp -147.28 138.42 23.8 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.896 0.878 . . . . 0.0 109.565 -172.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 52.42 27.04 4.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.002 1.321 . . . . 0.0 112.196 -177.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.82 4.3 90.39 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.585 1.088 . . . . 0.0 113.525 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -108.74 138.85 44.39 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.453 1.501 . . . . 0.0 108.751 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 51.2 m -83.15 136.99 34.24 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 72.3 t -135.07 138.41 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 32.0 m -120.48 147.43 24.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -158.73 162.37 37.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.93 0.395 . . . . 0.0 110.958 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -149.71 175.83 11.23 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.457 1.103 . . . . 0.0 108.514 170.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.4 p -142.37 146.65 35.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 169.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -145.44 149.03 33.97 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.318 1.047 . . . . 0.0 109.115 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 mp 50.36 -90.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.151 1.781 . . . . 0.0 110.989 -172.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -148.55 36.71 0.81 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.411 1.884 . . . . 0.0 108.99 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 64.3 tp -134.14 145.21 49.06 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 127.24 2.216 . . . . 0.0 107.889 -169.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -125.02 144.98 50.12 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -133.96 141.21 47.2 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.126 1.37 . . . . 0.0 107.515 -173.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -145.46 147.52 32.28 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.958 0.903 . . . . 0.0 110.271 -171.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.0 t -134.77 137.32 51.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 105.329 -2.1 . . . . 0.0 105.329 169.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -127.98 133.86 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 105.117 -2.179 . . . . 0.0 105.117 -172.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -154.79 176.35 32.55 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 122.311 0.95 . . . . 0.0 112.695 -178.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.3 m -63.71 129.97 42.3 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 113.798 -1.201 . . . . 0.0 109.225 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -67.23 125.18 25.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -153.79 -175.57 5.43 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.003 0.921 . . . . 0.0 109.442 -169.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.8 -14.16 30.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.629 1.571 . . . . 0.0 112.789 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -144.47 159.24 43.08 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.264 1.026 . . . . 0.0 110.061 174.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.43 -4.16 7.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.056 2.542 . . . . 0.0 109.944 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.2 -31.73 71.49 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.941 1.296 . . . . 0.0 110.722 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.1 ptt? -64.92 -34.34 78.16 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.24 0.927 . . . . 0.0 111.664 173.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -70.11 -46.67 64.35 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.0 mmt -55.61 -40.58 72.29 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.281 174.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.13 74.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.066 0.946 . . . . 0.0 109.896 -178.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.5 t -61.94 -44.12 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-O 118.946 -0.55 . . . . 0.0 110.074 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.67 -46.89 87.8 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.907 0.776 . . . . 0.0 110.665 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -63.8 -45.17 90.88 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 119.04 -0.505 . . . . 0.0 110.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.9 m -60.45 -44.65 95.63 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.154 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.14 -55.72 29.1 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.615 0.643 . . . . 0.0 110.171 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -62.71 -43.95 97.47 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.899 0.38 . . . . 0.0 110.632 -173.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -71.7 -37.02 70.73 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.707 -0.621 . . . . 0.0 111.166 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 t -56.59 -52.38 65.06 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.159 0.984 . . . . 0.0 109.691 174.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 77.1 mt -53.77 -48.44 69.75 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.8 m -56.43 -35.58 68.0 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.613 -0.708 . . . . 0.0 112.332 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -74.59 -47.71 30.89 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.571 1.078 . . . . 0.0 111.233 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 10.2 ptp -69.35 -38.95 78.37 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -169.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.327 2.7 pp -97.26 -5.24 37.24 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -174.136 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 49.82 30.3 3.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -147.07 179.03 7.9 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.814 1.646 . . . . 0.0 106.879 169.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.87 137.1 57.88 Favored 'General case' 0 C--O 1.23 0.078 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.5 m -76.31 45.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.318 1.847 . . . . 0.0 111.604 -174.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.3 170.15 7.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.84 0.856 . . . . 0.0 111.16 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -54.79 -42.28 71.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.829 -0.545 . . . . 0.0 112.117 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -65.81 -42.49 90.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.485 0.584 . . . . 0.0 109.64 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.23 81.56 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.286 0.494 . . . . 0.0 110.355 -177.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.298 0.0 OUTLIER -74.84 -28.59 60.75 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.073 0.851 . . . . 0.0 111.587 -179.255 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.8 tp -60.89 -39.65 90.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.768 1.167 . . . . 0.0 110.774 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.26 -14.1 62.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.519 0.727 . . . . 0.0 112.179 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -127.75 24.9 6.06 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.267 1.027 . . . . 0.0 111.64 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.29 -45.76 24.43 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.405 1.082 . . . . 0.0 112.29 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.79 -43.53 96.06 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.05 0.841 . . . . 0.0 110.775 -178.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.48 -43.18 99.41 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.7 tp -56.47 -52.43 64.74 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.969 1.308 . . . . 0.0 109.993 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -59.11 -44.84 92.0 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.181 0.446 . . . . 0.0 109.879 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.09 -37.59 86.16 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.804 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.19 91.91 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.981 0.81 . . . . 0.0 110.463 175.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 48.6 t -54.68 -49.04 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -71.6 2.7 4.79 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.016 1.326 . . . . 0.0 113.631 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -119.09 -17.04 9.06 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.533 1.533 . . . . 0.0 111.305 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.33 -46.3 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.25 154.36 30.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.406 1.082 . . . . 0.0 110.8 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -147.3 137.86 23.43 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 125.926 1.69 . . . . 0.0 107.257 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.89 25.48 52.9 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.43 18.09 76.6 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-N 118.149 0.974 . . . . 0.0 113.363 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.6 t -131.8 139.47 50.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 119.343 1.572 . . . . 0.0 107.043 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 18.4 pt -64.07 150.08 10.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 O-C-N 122.147 -0.346 . . . . 0.0 110.667 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -132.79 -14.51 2.77 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.2 1.0 . . . . 0.0 111.928 174.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -149.54 154.07 38.16 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 169.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.4 m -137.12 26.66 2.94 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.561 1.144 . . . . 0.0 110.906 -169.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -143.07 125.74 8.9 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.42 -33.9 10.34 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.295 1.996 . . . . 0.0 111.643 -169.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.86 -40.36 79.38 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -178.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -68.27 -39.84 82.05 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.542 0.61 . . . . 0.0 109.795 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.9 t -55.58 -52.9 42.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 118.741 0.701 . . . . 0.0 109.47 173.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.59 -40.48 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.499 1.045 . . . . 0.0 110.11 -179.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -63.02 -40.21 97.08 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.032 0.833 . . . . 0.0 111.044 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -68.57 -42.32 78.48 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.506 -0.746 . . . . 0.0 110.281 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 53.2 t -57.51 -43.22 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 118.595 0.634 . . . . 0.0 109.409 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.1 -33.58 73.74 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.409 0.684 . . . . 0.0 111.914 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 31.3 mt -72.26 -31.3 65.65 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.197 0.999 . . . . 0.0 112.137 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.967 176.539 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -150.86 170.01 20.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.987 1.315 . . . . 0.0 108.741 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.25 164.56 38.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 125.855 1.662 . . . . 0.0 108.042 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 66.0 tp -53.94 -36.49 62.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 111.857 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.2 pt -128.29 50.5 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 126.565 1.946 . . . . 0.0 108.457 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -54.11 -30.66 49.47 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.751 -0.593 . . . . 0.0 109.861 169.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -141.46 147.73 47.57 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 129.76 3.224 . . . . 0.0 103.06 168.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.84 84.48 0.67 Allowed 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 123.348 2.698 . . . . 0.0 109.55 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.4 m -78.96 1.61 23.14 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.222 1.409 . . . . 0.0 112.368 -170.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -149.14 165.11 32.75 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.299 2.239 . . . . 0.0 108.044 175.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -60.71 135.29 57.72 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 122.764 0.426 . . . . 0.0 110.103 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 34.3 p -80.66 -44.02 19.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 p -122.27 121.57 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.745 1.218 . . . . 0.0 108.037 -169.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.465 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 68.0 mmtt -75.06 -42.16 57.51 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 123.655 0.782 . . . . 0.0 109.362 174.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.28 165.72 23.92 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.233 0.47 . . . . 0.0 111.196 -171.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.27 131.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.9 mt -130.41 148.16 52.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mt -138.54 118.84 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 173.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.7 mt -122.68 143.04 50.04 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -175.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.41 167.79 13.96 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 169.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -57.29 -22.03 38.94 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.67 -25.5 20.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.727 1.149 . . . . 0.0 111.305 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.81 6.97 5.79 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 126.046 1.784 . . . . 0.0 112.557 173.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.29 129.48 40.02 Favored 'General case' 0 C--N 1.338 0.075 0 CA-C-N 119.088 1.444 . . . . 0.0 109.789 -178.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -66.32 94.59 0.27 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 109.288 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -50.87 61.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 168.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -148.78 153.09 37.66 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -156.87 147.55 21.58 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 169.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.7 OUTLIER -143.51 147.89 35.17 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.077 1.351 . . . . 0.0 107.504 169.913 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -137.73 143.76 41.36 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.91 1.684 . . . . 0.0 106.482 -175.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.06 -2.99 5.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.262 1.025 . . . . 0.0 112.621 -173.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -131.04 162.71 29.21 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.842 0.746 . . . . 0.0 109.08 -177.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -71.72 7.27 1.56 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.833 2.053 . . . . 0.0 112.505 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 p -61.68 -52.7 63.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.46 1.504 . . . . 0.0 110.207 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -144.29 70.75 16.12 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 124.64 1.176 . . . . 0.0 109.039 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.02 -1.62 9.43 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 122.667 2.245 . . . . 0.0 113.69 -172.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 m -136.49 139.38 42.26 Favored 'General case' 0 C--N 1.34 0.174 0 C-N-CA 123.971 0.908 . . . . 0.0 109.773 -169.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.5 t -46.42 -49.1 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 126.066 1.746 . . . . 0.0 113.025 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -58.47 -43.31 88.85 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.722 0.692 . . . . 0.0 111.406 -176.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.14 -32.18 58.98 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.856 0.298 . . . . 0.0 110.299 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -62.48 -48.73 78.32 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.252 0.621 . . . . 0.0 110.231 175.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -59.79 -35.71 75.23 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.983 0.811 . . . . 0.0 111.178 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.05 -44.86 75.43 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.02 0.528 . . . . 0.0 109.961 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.77 -38.35 90.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.077 0.551 . . . . 0.0 111.005 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.75 -41.25 96.06 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.701 1.6 . . . . 0.0 110.872 177.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.3 mmtt -60.34 -45.9 91.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.708 -0.62 . . . . 0.0 109.769 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.2 -48.12 77.04 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.431 0.692 . . . . 0.0 111.176 174.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mm -56.68 -54.07 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 C-N-CA 124.41 1.084 . . . . 0.0 108.546 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -60.28 -48.99 79.37 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.174 0.59 . . . . 0.0 109.926 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -60.37 -39.66 88.02 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.517 1.127 . . . . 0.0 112.692 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt -73.37 -50.04 24.04 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 121.645 -0.659 . . . . 0.0 109.344 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.404 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 33.1 p -70.39 -31.87 69.28 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -69.11 -5.37 21.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.938 0.79 . . . . 0.0 112.527 173.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtp-105 -126.78 28.27 5.89 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.388 1.875 . . . . 0.0 109.353 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.495 HG21 ' HB2' ' A' ' 60' ' ' ALA . 99.4 m -134.47 158.17 44.59 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.913 1.685 . . . . 0.0 108.048 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 29.05 0.46 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.542 1.537 . . . . 0.0 113.324 -169.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m 67.81 -179.53 0.22 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.016 1.726 . . . . 0.0 113.319 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.7 pt-20 56.62 -43.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 131.362 3.865 . . . . 0.0 117.006 -176.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.6 tt -154.89 155.25 6.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 120.21 1.368 . . . . 0.0 109.772 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.495 ' HB2' HG21 ' A' ' 55' ' ' THR . . . -148.5 172.69 14.08 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.487 1.915 . . . . 0.0 108.389 172.087 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -134.43 121.24 20.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 103.64 -2.726 . . . . 0.0 103.64 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.2 mt -78.14 -69.08 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.062 -168.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -142.53 7.9 1.74 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.548 1.939 . . . . 0.0 110.281 -176.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.82 -43.73 0.78 Allowed Glycine 0 CA--C 1.525 0.662 0 C-N-CA 126.241 1.877 . . . . 0.0 108.703 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.6 mt -68.49 129.31 39.56 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.826 0.85 . . . . 0.0 109.889 174.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 85.3 m -78.76 148.13 33.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.4 p -140.13 130.9 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 171.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -101.3 144.8 12.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 25.7 p90 -160.11 162.16 33.97 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.004 0.366 . . . . 0.0 111.61 -175.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -154.46 -179.85 8.34 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 169.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -135.26 149.24 49.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 123.885 0.874 . . . . 0.0 109.094 170.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -146.44 142.2 27.9 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.3 mt 61.68 -84.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 126.703 2.001 . . . . 0.0 110.85 174.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -148.99 25.77 0.91 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.236 2.614 . . . . 0.0 109.737 -176.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.27 150.48 51.49 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.194 2.198 . . . . 0.0 109.581 -169.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -130.35 143.62 50.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.53 1.532 . . . . 0.0 107.582 170.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -135.89 137.42 41.41 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.801 1.24 . . . . 0.0 107.669 -170.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -144.08 144.6 31.69 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 -171.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 62.0 t -135.74 121.79 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.39 134.29 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 -173.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.465 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -149.42 172.39 29.44 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 122.005 0.781 . . . . 0.0 113.325 -174.314 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.5 m -64.72 164.16 12.65 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.466 -1.367 . . . . 0.0 109.277 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.9 m -129.01 29.12 5.24 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.915 0.886 . . . . 0.0 110.752 -169.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 38.8 p90 -61.69 -34.56 75.96 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.873 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -160.72 -33.31 0.05 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.484 0.584 . . . . 0.0 112.418 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.24 171.77 14.45 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.693 0.797 . . . . 0.0 111.487 -170.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.1 -2.5 2.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.888 2.475 . . . . 0.0 110.69 -174.262 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -66.16 -33.61 76.17 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 124.266 1.026 . . . . 0.0 110.714 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -32.49 74.08 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.643 0.656 . . . . 0.0 111.253 173.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.8 mt -70.25 -43.64 70.11 Favored 'General case' 0 C--O 1.23 0.067 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.8 mmt -55.82 -40.89 73.41 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.064 173.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -47.87 78.7 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.121 0.568 . . . . 0.0 110.468 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.25 -46.92 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.696 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 60.4 tp -60.07 -45.65 92.2 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.575 0.625 . . . . 0.0 110.514 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -63.24 -47.08 83.98 Favored 'General case' 0 C--N 1.338 0.094 0 CA-C-O 119.146 -0.455 . . . . 0.0 110.237 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.7 m -61.55 -44.66 96.63 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.192 0.451 . . . . 0.0 110.389 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.6 tp -60.5 -53.57 55.88 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.887 0.875 . . . . 0.0 110.791 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.82 -41.41 97.86 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.684 0.278 . . . . 0.0 110.908 -177.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -75.03 -31.81 61.42 Favored 'General case' 0 N--CA 1.456 -0.141 0 O-C-N 121.51 -0.744 . . . . 0.0 111.294 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -62.67 -47.75 82.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.916 0.78 . . . . 0.0 110.023 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.5 mt -51.7 -51.42 56.16 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -34.12 69.77 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -71.67 -41.55 68.56 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.645 1.111 . . . . 0.0 111.437 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -97.85 3.36 49.85 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -171.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.8 tp -141.32 58.19 1.52 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.208 1.803 . . . . 0.0 107.902 -172.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -69.54 49.83 0.09 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.49 2.316 . . . . 0.0 112.9 -171.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.7 pttt -137.55 -67.86 0.48 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.848 1.259 . . . . 0.0 109.318 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -159.45 149.19 18.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 174.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.5 m -90.91 50.42 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-O 121.809 0.814 . . . . 0.0 109.71 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.95 167.9 11.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.872 1.269 . . . . 0.0 111.275 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -49.15 -54.66 15.33 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.155 1.382 . . . . 0.0 112.743 -171.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -62.04 -42.64 99.4 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 122.462 0.305 . . . . 0.0 110.499 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.49 -38.58 87.56 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.388 0.54 . . . . 0.0 110.582 -177.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.79 -45.37 92.96 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 121.421 -0.799 . . . . 0.0 110.207 174.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 68.6 tp -57.28 -38.25 73.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.288 0.635 . . . . 0.0 111.322 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -71.5 -16.99 62.37 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.92 23.54 4.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.404 1.002 . . . . 0.0 112.685 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -37.41 -50.09 1.05 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.334 1.854 . . . . 0.0 113.179 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -62.12 -40.3 95.44 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.539 1.063 . . . . 0.0 111.377 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.76 -45.86 94.86 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 177.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.75 -51.08 71.48 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.021 0.928 . . . . 0.0 110.747 175.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -54.43 -48.39 71.73 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 109.6 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.78 -33.31 66.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.434 -175.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.84 -44.48 96.02 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 119.37 0.987 . . . . 0.0 109.843 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -58.04 -45.77 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.448 0.567 . . . . 0.0 109.482 175.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -3.02 6.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.687 1.195 . . . . 0.0 113.506 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -115.29 -17.97 11.19 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.222 1.409 . . . . 0.0 111.745 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 55.6 mt -86.1 -30.35 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.265 1.026 . . . . 0.0 109.179 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.6 t -139.97 147.59 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 125.245 1.418 . . . . 0.0 107.938 -170.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -143.31 130.84 21.16 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.86 1.264 . . . . 0.0 107.646 170.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.9 52.1 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.538 175.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.01 16.45 79.5 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-N 118.225 1.012 . . . . 0.0 113.684 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 57.4 t -127.87 142.32 44.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 44.2 pt -54.53 142.9 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.526 0.679 . . . . 0.0 110.562 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.53 -42.3 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.996 1.718 . . . . 0.0 108.317 -175.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -144.86 156.42 44.0 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.135 0.974 . . . . 0.0 108.716 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -135.29 24.92 3.51 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.152 1.381 . . . . 0.0 110.49 -172.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -141.84 118.1 7.18 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 124.377 1.071 . . . . 0.0 108.87 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 -32.57 11.59 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.701 2.267 . . . . 0.0 111.79 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.19 -40.44 86.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -69.63 -36.55 76.24 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.816 0.735 . . . . 0.0 110.298 177.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.7 t -56.78 -55.68 18.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 123.236 0.614 . . . . 0.0 109.396 175.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 34.1 m -67.18 -30.14 48.32 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 CA-C-N 119.2 0.909 . . . . 0.0 111.287 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.54 -51.88 67.56 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.017 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -62.53 -40.77 97.83 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.73 1.15 . . . . 0.0 110.844 178.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 t -56.66 -45.93 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.104 0.411 . . . . 0.0 110.384 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -79.62 -26.52 41.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.026 0.83 . . . . 0.0 111.452 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 63.7 tp -71.88 -22.29 61.53 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.396 1.879 . . . . 0.0 112.1 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.0 ptt-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.083 1.353 . . . . 0.0 113.167 178.632 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -159.83 -177.81 6.61 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.046 1.738 . . . . 0.0 108.032 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -146.42 167.49 23.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.22 1.408 . . . . 0.0 109.153 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.02 -27.03 68.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.536 0.734 . . . . 0.0 111.94 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.2 mt -127.73 54.92 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -54.11 -36.42 63.2 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.932 0.893 . . . . 0.0 109.808 174.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -134.19 141.36 39.11 Favored Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 169.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.42 -4.08 13.09 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.795 2.997 . . . . 0.0 112.881 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -53.7 -27.7 29.58 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.327 1.451 . . . . 0.0 112.243 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 26.13 81.61 0.01 OUTLIER 'General case' 0 C--N 1.348 0.503 0 C-N-CA 129.085 2.954 . . . . 0.0 113.002 173.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -63.55 115.16 4.42 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.7 p -66.85 -26.83 67.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 109.993 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -135.6 141.1 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -100.06 -27.34 13.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 117.682 -1.152 . . . . 0.0 109.723 173.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.27 166.09 28.19 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.56 1.073 . . . . 0.0 111.916 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.9 mt -134.01 137.19 52.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -134.11 150.79 51.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.405 HG22 HD11 ' A' ' 75' ' ' LEU . 61.0 mt -137.69 114.35 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 102.925 -2.991 . . . . 0.0 102.925 169.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 46.2 mt -117.29 147.78 42.27 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 122.238 1.018 . . . . 0.0 110.164 -169.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -68.85 172.55 6.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 113.449 -1.705 . . . . 0.0 107.928 169.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -78.08 35.6 0.21 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.05 2.14 . . . . 0.0 111.126 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -149.09 8.1 0.73 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.696 2.398 . . . . 0.0 110.838 178.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.11 47.91 69.29 Favored Glycine 0 C--N 1.342 0.872 0 O-C-N 120.883 -1.136 . . . . 0.0 110.767 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -123.97 126.7 46.77 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 118.013 0.906 . . . . 0.0 108.846 -178.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -60.61 107.98 0.76 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.78 0.832 . . . . 0.0 110.888 -177.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -74.12 -41.59 61.37 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 155.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -141.14 149.1 41.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.081 1.352 . . . . 0.0 108.208 171.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.55 144.02 16.55 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -148.23 147.63 29.59 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.013 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -135.49 149.11 49.44 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.624 1.57 . . . . 0.0 106.978 -176.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -133.54 -1.36 3.14 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.974 0.91 . . . . 0.0 111.92 -174.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -135.05 159.4 41.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.927 0.785 . . . . 0.0 110.036 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -73.53 2.28 8.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.021 2.129 . . . . 0.0 113.043 -169.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -59.64 -47.54 85.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.337 1.055 . . . . 0.0 110.724 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -144.87 79.38 12.11 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.53 1.132 . . . . 0.0 108.261 -177.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -92.67 -0.6 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.864 2.376 . . . . 0.0 113.504 -174.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 m -134.31 138.05 44.67 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.131 0.972 . . . . 0.0 109.814 -169.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.24 -44.85 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.257 1.423 . . . . 0.0 113.532 -169.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -61.14 -44.62 97.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 117.959 0.345 . . . . 0.0 110.646 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -78.9 -32.51 45.78 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.66 -50.1 73.86 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.355 0.525 . . . . 0.0 110.455 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -62.39 -33.46 74.8 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.064 -1.023 . . . . 0.0 111.153 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.5 73.69 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.946 -0.471 . . . . 0.0 109.866 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.17 -37.96 81.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.657 0.783 . . . . 0.0 110.699 175.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -63.33 -42.81 98.99 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.793 1.637 . . . . 0.0 110.997 176.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -61.36 -44.65 96.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.164 0.893 . . . . 0.0 110.447 172.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.15 -45.48 87.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.077 0.551 . . . . 0.0 111.198 177.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.1 mm -58.28 -53.91 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.377 1.071 . . . . 0.0 108.394 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.19 -43.74 95.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.73 0.412 . . . . 0.0 110.813 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -56.03 -48.24 76.33 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.347 0.659 . . . . 0.0 110.641 174.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -61.67 -50.66 71.6 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 118.107 0.412 . . . . 0.0 109.925 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.9 p -71.74 -31.16 66.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.925 0.784 . . . . 0.0 111.801 -171.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -62.88 -16.53 59.16 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.718 0.69 . . . . 0.0 111.467 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -117.95 25.0 10.66 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.093 1.757 . . . . 0.0 109.814 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.8 m -133.52 158.54 42.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.312 1.845 . . . . 0.0 107.554 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.97 -48.15 80.09 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 118.443 -0.789 . . . . 0.0 112.371 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.0 m 153.91 -175.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 131.768 4.027 . . . . 0.0 108.192 -177.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.2 pt-20 59.62 -43.4 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 131.486 3.914 . . . . 0.0 117.427 173.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.9 tt -155.3 153.01 8.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 120.729 1.604 . . . . 0.0 110.024 -176.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.06 172.24 14.57 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 126.038 1.735 . . . . 0.0 108.429 170.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.5 tp -140.8 116.18 10.05 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.7 mp -84.65 -155.85 0.22 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.447 1.499 . . . . 0.0 108.912 178.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.61 15.63 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.187 2.595 . . . . 0.0 114.205 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.55 -10.54 1.28 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 126.004 1.764 . . . . 0.0 112.1 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.2 mt -112.88 119.8 39.24 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.358 1.079 . . . . 0.0 109.319 -171.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.2 m -72.69 144.34 47.74 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 171.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 3.9 p -136.97 134.34 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.45 137.99 45.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -154.69 166.63 32.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 120.595 0.235 . . . . 0.0 111.027 -169.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -152.05 175.91 12.06 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 123.763 0.825 . . . . 0.0 108.913 169.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 m -141.15 133.4 28.07 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -144.46 145.75 32.07 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.48 0.712 . . . . 0.0 109.957 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.8 mp 49.31 -86.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.971 2.108 . . . . 0.0 111.614 -171.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -149.06 28.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.961 2.104 . . . . 0.0 108.978 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.405 HD11 HG22 ' A' ' 18' ' ' ILE . 57.5 tp -132.96 144.66 50.27 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.529 1.532 . . . . 0.0 109.198 -169.344 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -125.78 137.44 53.79 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -129.13 141.36 51.21 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.646 1.178 . . . . 0.0 108.214 -171.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -147.23 148.54 31.58 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.809 0.844 . . . . 0.0 110.866 -169.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.5 t -135.84 125.71 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 170.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.3 mp -114.78 137.67 47.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 -177.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.33 178.41 35.48 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-O 122.519 1.066 . . . . 0.0 113.294 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.9 m -65.27 133.84 52.33 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 112.972 -1.614 . . . . 0.0 107.798 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 m -78.56 48.17 0.77 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.836 1.254 . . . . 0.0 110.831 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -72.55 64.97 0.64 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.041 2.537 . . . . 0.0 110.617 -174.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 54.53 14.19 0.79 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.393 2.277 . . . . 0.0 113.754 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.76 160.67 25.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 126.833 2.053 . . . . 0.0 107.48 -171.21 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.98 -5.64 1.89 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.062 2.145 . . . . 0.0 110.047 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -61.25 -34.42 75.12 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.447 1.099 . . . . 0.0 110.671 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.38 -33.91 76.94 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.022 0.828 . . . . 0.0 112.054 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.5 mt -71.77 -41.91 67.82 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.1 mtp -60.29 -37.06 79.35 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.714 173.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.01 63.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.713 0.805 . . . . 0.0 109.851 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -61.56 -44.91 99.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 118.237 0.471 . . . . 0.0 109.869 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.89 -51.44 69.6 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 123.261 0.624 . . . . 0.0 109.744 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -62.16 -45.57 92.81 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.631 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 85.8 m -60.99 -42.81 99.14 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.083 0.856 . . . . 0.0 111.073 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.4 tp -68.56 -48.18 64.93 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.92 0.782 . . . . 0.0 110.794 -177.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -64.15 -40.29 95.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.941 -0.475 . . . . 0.0 110.824 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -77.21 -33.8 56.19 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.239 -0.913 . . . . 0.0 111.624 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.5 p -64.86 -42.26 95.01 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.729 1.15 . . . . 0.0 109.85 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.5 mt -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -61.13 -13.59 18.64 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -94.9 -37.75 11.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 120.611 1.55 . . . . 0.0 112.111 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -97.92 -0.95 43.95 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.0 tp -134.99 52.64 2.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.981 1.712 . . . . 0.0 109.206 -171.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -68.73 61.9 0.1 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.77 2.028 . . . . 0.0 112.627 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.428 ' HG3' ' H ' ' A' ' 108' ' ' ASN . 15.0 ptmt -138.29 -66.58 0.49 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.319 1.848 . . . . 0.0 106.952 169.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASN . . . . . 0.428 ' H ' ' HG3' ' A' ' 107' ' ' LYS . 5.8 m-20 -163.6 150.04 11.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 129.102 2.961 . . . . 0.0 103.354 169.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.61 40.89 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 118.829 0.74 . . . . 0.0 109.962 171.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -86.2 172.74 10.29 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.242 1.017 . . . . 0.0 111.912 -173.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -54.81 -53.59 53.26 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 124.525 1.13 . . . . 0.0 112.51 -172.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.0 mmt180 -65.0 -39.23 93.15 Favored 'General case' 0 N--CA 1.463 0.202 0 O-C-N 121.979 -0.451 . . . . 0.0 110.19 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.53 -39.87 94.57 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.194 0.452 . . . . 0.0 111.228 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.303 0.0 OUTLIER -76.43 -29.78 57.14 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.98 -1.075 . . . . 0.0 110.864 178.39 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.6 tp -60.78 -36.14 78.25 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.726 0.694 . . . . 0.0 111.188 169.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -65.86 -25.72 67.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.679 -0.638 . . . . 0.0 112.711 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -131.01 31.9 4.39 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.823 0.849 . . . . 0.0 112.607 -173.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -39.18 -48.53 1.76 Allowed 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.816 1.646 . . . . 0.0 112.585 175.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -67.34 -35.45 79.4 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.676 0.671 . . . . 0.0 111.883 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.72 -42.53 99.76 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 172.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.75 -45.94 92.37 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.052 0.941 . . . . 0.0 111.23 173.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -54.99 -47.04 75.15 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.318 0.963 . . . . 0.0 109.788 175.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.3 mt -67.44 -32.8 73.91 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.673 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.59 -45.64 86.1 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.086 0.857 . . . . 0.0 110.151 174.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.33 -41.55 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 118.57 0.623 . . . . 0.0 109.924 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.91 -24.04 63.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.213 1.005 . . . . 0.0 112.574 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -91.85 -41.76 10.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.586 0.63 . . . . 0.0 110.927 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.65 -38.07 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 118.814 0.734 . . . . 0.0 109.481 -177.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.6 t -131.14 144.87 36.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.371 1.068 . . . . 0.0 109.21 -171.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -142.07 126.26 17.47 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 124.869 1.268 . . . . 0.0 107.687 169.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.92 30.29 59.97 Favored Glycine 0 CA--C 1.534 1.222 0 CA-C-O 119.361 -0.688 . . . . 0.0 113.35 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.32 12.21 84.79 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.335 1.067 . . . . 0.0 113.554 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.2 t -120.61 139.83 46.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 177.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.7 pt -56.4 138.82 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.196 0.522 . . . . 0.0 110.066 173.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -127.46 -35.62 2.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.581 1.553 . . . . 0.0 109.409 -171.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -138.93 151.64 47.07 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.5 m -139.24 29.25 2.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.776 1.231 . . . . 0.0 110.822 -169.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -137.98 121.69 11.57 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.31 -34.95 9.12 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.702 2.268 . . . . 0.0 113.634 -171.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -73.55 -38.35 65.27 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.162 0.892 . . . . 0.0 109.835 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -63.2 -37.23 86.41 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.167 0.894 . . . . 0.0 110.409 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.24 -53.52 38.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.686 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 26.3 m -66.5 -33.53 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 121.109 1.777 . . . . 0.0 112.263 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -61.6 -48.72 79.66 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.176 0.898 . . . . 0.0 109.554 177.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -70.21 -34.34 72.79 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.398 -0.814 . . . . 0.0 111.101 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 3.5 t -57.72 -45.77 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 121.394 -0.816 . . . . 0.0 109.633 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.05 -28.0 57.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 122.218 -0.301 . . . . 0.0 111.637 -175.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 54.3 mt -74.89 -26.57 59.75 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.286 1.034 . . . . 0.0 112.13 175.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 C--O 1.249 1.073 0 CA-C-N 119.14 0.882 . . . . 0.0 110.09 171.18 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.238 0.464 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.4 p -67.29 -33.46 75.35 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.33 128.05 57.96 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 169.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.45 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 23.6 mtpp -86.5 -30.3 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 118.201 -0.904 . . . . 0.0 108.747 174.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.38 167.56 27.09 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 119.222 0.919 . . . . 0.0 111.564 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.2 mt -136.47 131.42 48.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.8 mt -131.82 148.55 52.56 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mt -140.58 120.28 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 173.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 mt -124.15 147.13 48.2 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.69 169.41 11.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 169.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.7 -18.82 56.5 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.18 -23.03 18.71 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.452 1.024 . . . . 0.0 110.865 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.75 7.45 6.13 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.652 1.596 . . . . 0.0 112.435 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -68.01 130.09 41.91 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 119.355 1.578 . . . . 0.0 109.891 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -67.58 94.49 0.42 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.719 1.207 . . . . 0.0 109.838 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.3 mt -71.32 -47.75 54.71 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -147.01 152.44 38.6 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.384 0.674 . . . . 0.0 109.378 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.22 147.04 19.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 169.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 1.0 OUTLIER -145.41 147.89 32.72 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 169.76 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -136.73 147.23 46.61 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.816 1.646 . . . . 0.0 106.756 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -133.73 8.3 3.85 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.662 1.185 . . . . 0.0 110.929 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -136.12 148.3 48.17 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.725 0.81 . . . . 0.0 111.298 -169.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.84 -9.01 49.01 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.893 1.677 . . . . 0.0 114.002 -172.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 p -62.86 -40.84 98.71 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.093 -1.004 . . . . 0.0 112.136 176.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -141.77 64.96 19.17 Favored Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 118.951 0.796 . . . . 0.0 110.863 -173.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -86.52 -1.32 8.32 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.817 2.345 . . . . 0.0 113.451 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.6 m -134.98 140.21 45.5 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.028 0.931 . . . . 0.0 109.676 -169.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -45.2 -51.06 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 126.353 1.861 . . . . 0.0 113.01 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -59.05 -43.81 91.74 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.481 0.582 . . . . 0.0 111.201 -175.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.45 -33.59 62.96 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -61.38 -48.91 79.08 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.499 0.72 . . . . 0.0 110.15 174.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.36 -35.81 74.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.207 0.912 . . . . 0.0 111.488 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.78 -48.61 73.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -63.45 -38.0 89.45 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.011 0.524 . . . . 0.0 111.123 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.01 -41.63 97.4 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.758 1.623 . . . . 0.0 111.258 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.03 -38.93 79.45 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 121.576 -0.702 . . . . 0.0 110.12 176.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.6 -51.07 68.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.908 -0.568 . . . . 0.0 110.343 169.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.1 mm -53.55 -55.06 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 124.987 1.315 . . . . 0.0 108.001 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -59.41 -48.05 83.13 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.789 0.436 . . . . 0.0 110.898 -175.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -58.65 -45.96 88.2 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.732 -0.605 . . . . 0.0 111.225 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -71.15 -6.1 36.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 117.596 -1.192 . . . . 0.0 113.167 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.7 p -125.11 -37.25 2.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 120.862 1.664 . . . . 0.0 113.479 -169.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -70.17 -0.35 7.67 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 120.321 1.419 . . . . 0.0 112.622 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -123.27 20.58 9.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.769 2.028 . . . . 0.0 110.009 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 98.3 m -138.26 160.06 40.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.083 1.353 . . . . 0.0 109.33 -169.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.21 85.51 4.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.537 1.135 . . . . 0.0 109.627 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.4 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 4.0 m -46.8 139.28 5.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.402 1.881 . . . . 0.0 115.779 -170.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 152.02 -37.49 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.321 1 C-N-CA 132.387 4.275 . . . . 0.0 107.521 170.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.31 155.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.462 1.105 . . . . 0.0 109.306 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.0 173.88 13.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.47 1.908 . . . . 0.0 108.324 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.0 tp -139.29 115.6 10.46 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.089 -2.189 . . . . 0.0 105.089 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.79 143.26 29.57 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.859 0.864 . . . . 0.0 109.848 -169.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 50.33 26.1 2.13 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.816 1.246 . . . . 0.0 112.721 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.68 9.98 82.18 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.054 1.312 . . . . 0.0 114.112 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.4 mt -123.81 130.88 53.32 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 126.093 1.757 . . . . 0.0 109.718 -172.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 m -74.49 142.19 44.85 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.88 132.61 34.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -101.61 149.84 6.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 33.5 p90 -154.67 163.83 39.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.575 0.702 . . . . 0.0 111.859 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -150.95 155.98 40.23 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.901 2.08 . . . . 0.0 106.184 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 m -140.06 143.94 36.59 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.4 m -145.16 128.58 16.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.795 0.838 . . . . 0.0 110.589 169.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.3 mt 57.59 -69.27 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 128.089 2.556 . . . . 0.0 114.783 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -146.09 19.84 1.41 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.208 2.203 . . . . 0.0 109.327 -171.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -138.73 147.01 42.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.471 1.508 . . . . 0.0 110.558 -168.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -132.97 141.35 48.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.694 1.598 . . . . 0.0 106.97 169.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -128.35 136.83 51.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.9 1.68 . . . . 0.0 107.038 -172.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -143.14 145.84 33.19 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.116 0.871 . . . . 0.0 110.478 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.8 t -136.74 127.88 41.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.72 136.15 59.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.45 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -157.87 -173.72 26.65 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 121.942 0.746 . . . . 0.0 112.394 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -67.84 171.22 6.85 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 113.824 -1.188 . . . . 0.0 110.041 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.3 m -130.21 28.52 4.99 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.465 1.106 . . . . 0.0 110.512 -171.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -59.24 -52.41 65.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.508 0.723 . . . . 0.0 112.324 -169.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -148.62 -12.87 0.34 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -153.28 164.96 37.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.788 1.176 . . . . 0.0 111.615 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.23 -3.58 5.61 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 127.699 2.4 . . . . 0.0 110.243 174.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.43 -32.96 74.8 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.37 1.068 . . . . 0.0 110.976 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.6 ptt? -64.05 -33.66 76.25 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.901 0.773 . . . . 0.0 111.638 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.7 mt -71.25 -45.99 62.0 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 10.1 mmt -54.67 -41.18 69.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.288 0.635 . . . . 0.0 110.433 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.43 -51.05 67.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 118.794 0.724 . . . . 0.0 110.129 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 53.3 t -62.29 -44.27 98.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 118.89 -0.576 . . . . 0.0 110.004 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 63.2 tp -62.09 -45.31 94.09 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.875 0.762 . . . . 0.0 110.781 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.5 t -59.51 -46.05 89.95 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.66 -51.52 66.9 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.604 1.161 . . . . 0.0 111.861 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -64.61 -40.82 96.18 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.183 -0.323 . . . . 0.0 110.65 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -75.15 -38.37 60.98 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.344 -0.848 . . . . 0.0 111.534 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 21.9 p -63.99 -41.33 97.54 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 119.352 0.978 . . . . 0.0 110.686 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.8 mt -53.88 -51.02 64.99 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 169.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.6 m -54.83 -36.53 65.1 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 118.633 -0.698 . . . . 0.0 112.008 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.466 ' HB2' HG21 ' A' ' 143' ' ' VAL . 48.4 mm-40 -72.5 -51.34 20.47 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.516 1.053 . . . . 0.0 111.634 176.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 58.5 mtm -69.16 -41.02 77.83 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.035 0.834 . . . . 0.0 110.298 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.8 mp -74.16 -31.41 62.69 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.775 0.83 . . . . 0.0 110.27 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 42.77 45.93 4.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.466 1.907 . . . . 0.0 111.258 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mmmt -145.9 -176.32 5.09 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 128.667 2.787 . . . . 0.0 106.868 -173.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.4 17.8 2.02 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.678 0.791 . . . . 0.0 111.396 -175.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.315 5.8 m 45.26 39.12 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 126.948 2.099 . . . . 0.0 111.949 -173.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -78.17 174.17 11.46 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.64 1.176 . . . . 0.0 110.897 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -50.66 67.73 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.066 0.946 . . . . 0.0 112.475 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -65.63 -38.71 90.17 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.199 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.84 -39.76 92.94 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.9 0.773 . . . . 0.0 110.624 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.26 -46.08 78.29 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.737 0.699 . . . . 0.0 111.047 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.9 tp -58.15 -38.64 76.99 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.966 0.507 . . . . 0.0 110.946 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -68.46 -16.97 64.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.251 1.02 . . . . 0.0 113.137 176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -132.52 22.51 4.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.295 0.952 . . . . 0.0 112.214 -169.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -45.0 -45.69 10.77 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.133 1.373 . . . . 0.0 111.905 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.34 -42.35 96.31 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.005 0.82 . . . . 0.0 111.371 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.33 -44.29 98.26 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.3 tp -57.46 -51.04 71.05 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.218 1.007 . . . . 0.0 110.709 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -56.21 -47.32 78.63 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.347 0.521 . . . . 0.0 109.773 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.8 mt -69.63 -30.78 68.58 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.043 -0.503 . . . . 0.0 111.781 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.92 -46.4 78.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.131 0.878 . . . . 0.0 109.706 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.6 t -57.87 -40.65 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.449 0.568 . . . . 0.0 109.77 176.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -63.0 -8.35 7.11 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.28 1.432 . . . . 0.0 113.905 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.27 -31.67 5.9 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.686 1.195 . . . . 0.0 111.723 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 72.6 mt -66.27 -41.08 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 109.085 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.5 m -140.38 160.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.327 1.051 . . . . 0.0 109.875 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -148.6 127.57 12.73 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.197 1.399 . . . . 0.0 107.671 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.16 31.53 56.35 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.34 -0.7 . . . . 0.0 113.434 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.6 11.21 85.5 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.2 1.0 . . . . 0.0 113.823 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -117.61 137.27 52.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 pt -55.14 138.03 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.321 0.581 . . . . 0.0 110.33 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -126.11 -39.97 2.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.41 1.484 . . . . 0.0 108.838 -172.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -145.26 150.82 37.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.57 0.623 . . . . 0.0 109.386 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.4 m -135.05 24.63 3.58 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.902 1.281 . . . . 0.0 111.144 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -128.71 118.77 19.97 Favored Pre-proline 0 C--O 1.236 0.375 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.19 -42.57 2.86 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 121.743 1.629 . . . . 0.0 112.255 -169.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.3 pp0? -70.51 -26.06 63.42 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.555 1.07 . . . . 0.0 110.776 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.41 -45.08 70.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.652 1.115 . . . . 0.0 109.975 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 16.6 t -52.6 -48.91 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.466 HG21 ' HB2' ' A' ' 103' ' ' GLN . 79.6 t -60.9 -41.53 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-O 118.201 -0.905 . . . . 0.0 111.014 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -57.62 -46.9 83.54 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.618 1.099 . . . . 0.0 109.448 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -65.14 -40.3 94.24 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.638 -0.664 . . . . 0.0 111.466 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 96.6 t -63.81 -43.55 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 118.811 0.732 . . . . 0.0 109.555 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.93 -35.74 80.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.02 0.528 . . . . 0.0 111.086 -178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.0 mt -76.66 -28.39 55.97 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.706 1.202 . . . . 0.0 112.519 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 . . . . . 0 C--O 1.25 1.086 0 CA-C-N 118.921 0.782 . . . . 0.0 110.187 172.365 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.234 0.265 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.6 p -71.78 -42.5 67.06 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 81.4 t -123.07 118.59 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -83.39 -33.99 25.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.13 175.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.89 167.27 24.97 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.412 1.005 . . . . 0.0 111.255 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -135.4 133.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 mt -132.98 146.77 52.07 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.557 ' CG2' HD11 ' A' ' 75' ' ' LEU . 54.2 mt -136.67 116.31 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 169.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.79 147.9 47.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.593 0.711 . . . . 0.0 110.486 -169.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -66.35 171.64 4.67 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.882 169.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 21.18 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.857 2.063 . . . . 0.0 114.111 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -136.45 11.48 3.23 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.469 1.908 . . . . 0.0 110.602 172.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.98 35.51 71.95 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 120.825 -1.172 . . . . 0.0 111.296 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -104.23 132.53 50.38 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.421 1.111 . . . . 0.0 109.29 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -58.87 114.88 2.76 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.834 0.854 . . . . 0.0 110.404 -174.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.5 mt -91.17 -42.66 10.32 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 156.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -145.47 149.03 33.92 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 169.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.12 144.25 12.8 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 168.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? -145.67 147.19 31.72 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.066 1.346 . . . . 0.0 107.689 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -132.19 150.44 52.15 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.834 1.654 . . . . 0.0 107.272 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -133.59 9.61 3.97 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.332 1.453 . . . . 0.0 110.597 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -129.2 150.18 50.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.283 1.433 . . . . 0.0 108.871 -169.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.16 -1.32 56.76 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.215 1.006 . . . . 0.0 112.98 -169.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 m -70.47 -34.32 72.26 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.683 0.674 . . . . 0.0 110.763 175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -140.56 67.23 30.05 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.058 0.943 . . . . 0.0 110.133 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -90.15 -2.71 5.42 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.705 2.27 . . . . 0.0 113.458 -174.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.4 m -135.45 145.75 47.52 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.003 0.921 . . . . 0.0 109.757 -169.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.5 t -45.54 -52.35 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 126.178 1.791 . . . . 0.0 113.036 -169.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.53 -45.5 88.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.755 0.707 . . . . 0.0 111.06 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.4 -35.06 65.8 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -177.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -61.12 -50.21 74.12 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.772 0.829 . . . . 0.0 110.047 174.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -60.14 -36.21 77.02 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.282 -0.886 . . . . 0.0 111.385 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.05 -47.64 76.63 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.09 0.556 . . . . 0.0 109.65 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -61.47 -37.66 84.43 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.432 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.2 -37.34 87.0 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.188 1.395 . . . . 0.0 112.042 176.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.92 -47.45 80.5 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.394 0.997 . . . . 0.0 109.236 172.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.31 -50.95 66.17 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.366 0.417 . . . . 0.0 110.551 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.5 -55.66 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 125.408 1.483 . . . . 0.0 108.415 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -66.8 -43.79 82.97 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 117.995 0.361 . . . . 0.0 110.782 -172.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.93 -50.39 70.86 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.59 0.356 . . . . 0.0 110.31 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.1 mmtm -66.16 -50.18 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 122.278 0.231 . . . . 0.0 110.531 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 38.4 p -70.82 -35.67 72.59 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -168.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.9 p-80 -71.08 -1.42 12.2 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 120.359 1.436 . . . . 0.0 112.266 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -122.72 23.16 9.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.57 1.948 . . . . 0.0 109.726 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.2 m -132.94 160.01 38.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.977 1.711 . . . . 0.0 108.268 -177.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -80.99 28.88 0.35 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.754 1.621 . . . . 0.0 113.282 -169.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.454 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 3.9 m 67.69 -177.62 0.21 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.168 1.787 . . . . 0.0 113.725 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 10.6 pt-20 57.91 -46.01 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 131.522 3.929 . . . . 0.0 117.078 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.4 tt -152.88 154.64 7.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 120.461 1.482 . . . . 0.0 109.785 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.11 174.08 13.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.65 1.58 . . . . 0.0 109.01 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.37 105.73 6.38 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 178.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.8 mt -127.84 132.56 49.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 52.98 26.58 4.83 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.655 1.182 . . . . 0.0 112.515 176.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 1.74 77.67 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.815 1.198 . . . . 0.0 113.945 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -112.22 142.8 44.26 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 119.381 1.59 . . . . 0.0 110.622 -177.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.9 m -75.12 141.07 43.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 171.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.68 134.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.18 147.3 15.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.193 -1.781 . . . . 0.0 106.193 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 32.5 p90 -156.68 158.57 37.21 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.969 0.414 . . . . 0.0 111.677 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -147.3 175.22 10.94 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.125 0.97 . . . . 0.0 108.383 169.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 p -145.15 149.06 34.31 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.0 m -147.69 147.42 29.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.326 1.05 . . . . 0.0 109.274 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 mp 49.53 -87.65 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 126.937 2.095 . . . . 0.0 112.109 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -145.26 26.0 1.35 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.849 2.06 . . . . 0.0 109.277 -176.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.557 HD11 ' CG2' ' A' ' 18' ' ' ILE . 62.3 tp -131.23 147.43 52.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.388 1.875 . . . . 0.0 109.347 -169.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -126.41 145.18 50.57 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.3 139.81 49.65 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.454 1.502 . . . . 0.0 107.422 -172.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -146.24 147.86 31.87 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.824 0.85 . . . . 0.0 111.029 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 93.5 t -135.68 127.82 46.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 169.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mm -114.63 135.83 53.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -171.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.19 173.64 32.01 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.84 1.244 . . . . 0.0 112.019 -172.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -68.96 167.92 14.8 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.13 -1.535 . . . . 0.0 111.139 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.0 m -61.14 -46.97 88.39 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 170.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 10.3 t80 50.23 -167.11 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.048 2.139 . . . . 0.0 112.084 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -83.83 -14.91 50.11 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.589 -0.694 . . . . 0.0 111.405 171.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -161.19 163.13 31.37 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 124.89 1.276 . . . . 0.0 110.398 -172.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.09 -6.39 10.91 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.858 2.463 . . . . 0.0 110.452 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.17 -32.76 72.5 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 124.947 1.299 . . . . 0.0 110.571 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -64.06 -33.33 75.5 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.847 0.749 . . . . 0.0 111.601 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.4 mt -72.64 -44.24 62.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.6 mmt -54.33 -42.01 69.71 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.374 172.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -48.49 77.43 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.542 0.737 . . . . 0.0 110.236 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.93 -44.67 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.018 0.527 . . . . 0.0 110.277 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 47.3 tp -60.39 -51.84 67.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 118.618 0.645 . . . . 0.0 110.035 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -71.55 -31.83 67.45 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 118.584 -0.722 . . . . 0.0 110.989 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.76 -49.63 76.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.082 0.855 . . . . 0.0 109.659 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.72 -46.12 89.57 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.739 0.699 . . . . 0.0 110.709 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.74 -43.57 98.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.013 0.525 . . . . 0.0 111.346 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.73 -36.61 67.8 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 121.432 -0.792 . . . . 0.0 110.886 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.7 m -63.62 -44.15 94.77 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.765 0.711 . . . . 0.0 110.927 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.5 mt -52.26 -53.62 41.56 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.0 m -55.84 -40.42 72.83 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.412 0.445 . . . . 0.0 111.565 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -67.64 -43.75 79.58 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.999 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 12.5 ptt? -83.37 -29.05 28.52 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.59 1.086 . . . . 0.0 112.312 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.409 HD21 ' HB1' ' A' ' 113' ' ' ALA . 17.3 tp -88.79 -33.48 17.42 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.2 0.6 . . . . 0.0 112.24 -169.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 49.96 33.09 6.24 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.936 1.694 . . . . 0.0 114.132 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -153.1 -174.93 5.11 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.909 1.684 . . . . 0.0 106.908 169.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -48.19 125.77 9.87 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 m -78.01 45.13 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.616 1.166 . . . . 0.0 109.322 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -80.4 163.85 23.53 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.751 0.82 . . . . 0.0 109.994 176.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -59.11 -36.52 75.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -169.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.0 tpp85 -65.4 -42.02 93.03 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.013 0.824 . . . . 0.0 110.138 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.409 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -67.58 -33.41 74.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.478 0.581 . . . . 0.0 110.787 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.5 -44.59 86.53 Favored 'General case' 0 N--CA 1.461 0.094 0 O-C-N 121.404 -0.81 . . . . 0.0 110.905 171.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.79 -38.38 72.43 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.435 0.694 . . . . 0.0 110.862 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.29 -21.99 65.66 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.24 27.27 5.37 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.466 1.03 . . . . 0.0 112.977 -175.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -40.88 -48.47 3.12 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 125.666 1.586 . . . . 0.0 112.922 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.7 -39.61 94.55 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.985 0.811 . . . . 0.0 111.304 -177.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.13 -43.56 92.99 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -58.22 -51.06 71.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.322 1.049 . . . . 0.0 110.298 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -56.29 -46.03 79.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.332 0.653 . . . . 0.0 109.961 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.85 -40.41 91.68 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-O 118.885 -0.579 . . . . 0.0 111.372 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.76 -46.45 90.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.93 0.786 . . . . 0.0 109.694 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.6 -46.47 86.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.302 0.501 . . . . 0.0 109.904 175.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.46 -21.83 66.53 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 112.936 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -92.01 -28.72 17.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.895 0.878 . . . . 0.0 110.656 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.1 mt -80.06 -37.46 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 118.967 0.803 . . . . 0.0 109.525 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 20.6 t -140.14 143.67 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.308 1.043 . . . . 0.0 108.923 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -145.69 134.55 22.45 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.584 1.154 . . . . 0.0 107.982 169.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.82 29.46 54.89 Favored Glycine 0 CA--C 1.533 1.156 0 CA-C-O 119.537 -0.591 . . . . 0.0 112.965 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.33 14.38 79.3 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 117.98 0.89 . . . . 0.0 113.949 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 26.6 t -120.04 135.54 60.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 24.1 pt -60.96 157.38 2.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-O 121.141 0.496 . . . . 0.0 110.411 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.5 mt -118.18 -48.48 2.53 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 124.272 1.029 . . . . 0.0 108.765 173.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -157.14 156.54 32.86 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.153 1.381 . . . . 0.0 107.563 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.4 p -140.44 17.26 2.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.986 0.914 . . . . 0.0 111.801 -174.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.66 114.96 63.09 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 169.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.38 -32.84 31.52 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.968 1.779 . . . . 0.0 113.025 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.15 -48.84 74.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.696 0.68 . . . . 0.0 109.183 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -66.22 -40.93 90.65 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.347 -0.846 . . . . 0.0 109.948 -175.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -56.75 -57.07 10.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 123.866 0.866 . . . . 0.0 109.509 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.23 -39.63 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.406 0.548 . . . . 0.0 110.466 -172.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -63.04 -44.05 96.97 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.637 0.653 . . . . 0.0 110.311 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -61.09 -46.24 91.45 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.672 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.68 -27.23 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 119.606 1.094 . . . . 0.0 111.881 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.53 -38.83 74.28 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.858 0.753 . . . . 0.0 111.281 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 49.1 mt -71.01 -38.54 72.63 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.827 0.851 . . . . 0.0 110.944 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.246 176.43 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.9 p -68.85 -36.01 77.62 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -135.52 142.8 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 169.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -98.76 -25.82 14.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 117.636 -1.174 . . . . 0.0 109.978 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.19 166.49 29.59 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.672 1.123 . . . . 0.0 112.059 174.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.95 133.06 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 104.654 -2.35 . . . . 0.0 104.654 172.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.6 mt -135.09 149.96 50.15 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.8 mt -138.91 124.22 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.532 -2.395 . . . . 0.0 104.532 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.9 mt -121.47 147.95 45.08 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -173.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.23 168.15 12.88 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.552 0.692 . . . . 0.0 109.727 169.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -55.11 -20.49 10.13 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.0 0.83 30.38 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.62 1.1 . . . . 0.0 111.494 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.06 17.44 43.56 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.953 1.263 . . . . 0.0 112.771 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.89 137.93 39.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.305 1.552 . . . . 0.0 109.878 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -60.33 120.62 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 175.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.2 mt -97.67 -44.53 6.73 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 163.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -145.23 151.3 38.18 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.123 173.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.51 144.69 15.6 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 169.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -147.51 148.97 31.76 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.77 1.228 . . . . 0.0 107.856 171.877 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -136.88 148.1 46.87 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.779 1.631 . . . . 0.0 106.925 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -133.89 2.55 3.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.973 0.909 . . . . 0.0 111.568 -174.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -132.9 159.2 40.59 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.011 0.925 . . . . 0.0 108.991 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.87 5.57 3.16 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.274 2.23 . . . . 0.0 112.51 -174.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -61.62 -48.16 82.15 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.938 1.295 . . . . 0.0 110.58 177.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -143.9 73.69 16.6 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.533 1.133 . . . . 0.0 108.542 -177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.41 -0.69 6.02 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.654 2.236 . . . . 0.0 113.521 -171.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 m -135.04 139.78 45.08 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.061 0.944 . . . . 0.0 109.459 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -43.58 -53.04 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.607 1.963 . . . . 0.0 113.043 -169.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -62.51 -43.54 98.55 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.387 0.539 . . . . 0.0 111.115 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -68.93 -35.66 77.05 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -63.78 -50.97 66.91 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.367 0.667 . . . . 0.0 110.558 176.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.62 -37.64 73.63 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.398 -0.814 . . . . 0.0 110.877 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.21 -45.56 80.34 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -61.99 -37.95 86.76 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.101 0.56 . . . . 0.0 110.897 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.99 -42.17 97.29 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.751 1.62 . . . . 0.0 111.181 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -66.01 -42.26 89.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.472 -0.768 . . . . 0.0 109.919 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.55 -46.77 77.07 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.068 0.547 . . . . 0.0 110.849 173.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.9 mm -56.5 -54.95 22.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 C-N-CA 124.673 1.189 . . . . 0.0 108.301 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -60.14 -48.8 80.22 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.188 0.449 . . . . 0.0 110.842 -177.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -58.91 -39.76 82.49 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.549 1.14 . . . . 0.0 112.126 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -76.92 -47.49 20.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.135 0.574 . . . . 0.0 109.956 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.9 p -70.53 -26.81 63.74 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.454 -0.779 . . . . 0.0 112.403 -169.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -73.87 5.35 4.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.077 1.308 . . . . 0.0 112.428 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.08 14.09 9.79 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.309 1.844 . . . . 0.0 110.723 175.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.6 m -120.69 162.93 18.85 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.379 1.072 . . . . 0.0 109.318 -171.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -88.59 23.11 2.36 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.371 1.468 . . . . 0.0 112.992 -169.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.4 m 68.64 179.79 0.23 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 0.0 113.848 175.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.31 10.5 pt-20 56.94 -50.95 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 131.275 3.83 . . . . 0.0 116.13 -175.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.0 tt -151.54 155.29 7.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 120.377 1.444 . . . . 0.0 110.062 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.28 164.83 35.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.405 1.882 . . . . 0.0 109.23 -177.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.09 106.92 8.94 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 102.442 -3.17 . . . . 0.0 102.442 170.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mp -81.01 -64.51 1.17 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -168.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -139.8 7.15 2.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.592 1.557 . . . . 0.0 110.844 -172.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 144.84 -38.82 1.25 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 126.04 1.781 . . . . 0.0 109.383 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -80.01 139.44 36.97 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.137 0.975 . . . . 0.0 110.463 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 62.1 m -85.22 141.19 30.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.931 1.292 . . . . 0.0 107.556 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 93.7 t -138.19 131.3 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 106.338 -1.726 . . . . 0.0 106.338 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.6 m -107.91 145.29 15.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 169.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -156.86 159.19 37.95 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.93 0.395 . . . . 0.0 111.721 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -150.4 171.02 17.68 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.369 1.067 . . . . 0.0 108.562 170.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -143.71 140.89 30.24 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 m -146.77 142.07 27.37 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.541 0.737 . . . . 0.0 109.581 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 53.79 -85.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 127.176 2.191 . . . . 0.0 112.328 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -146.6 29.57 1.02 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.269 1.827 . . . . 0.0 108.911 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.459 HD21 HD22 ' A' ' 114' ' ' LEU . 50.0 tp -137.43 147.24 45.23 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.257 1.823 . . . . 0.0 109.446 -169.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -129.55 139.26 51.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -127.19 140.48 52.21 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.624 1.57 . . . . 0.0 107.938 -172.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -146.31 149.17 33.31 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.161 0.984 . . . . 0.0 111.396 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 86.0 t -140.6 140.76 33.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -130.82 134.99 61.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 -171.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.17 172.1 37.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-O 121.942 0.745 . . . . 0.0 113.065 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.4 m -63.08 129.27 39.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.207 1.403 . . . . 0.0 109.999 -173.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -77.01 33.45 0.15 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.204 1.802 . . . . 0.0 113.48 -172.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.08 169.57 8.25 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.21 1.004 . . . . 0.0 109.166 169.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.43 26.62 0.05 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.115 1.766 . . . . 0.0 113.484 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -138.09 46.78 2.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 125.785 1.634 . . . . 0.0 109.124 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -55.84 -14.97 2.7 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.439 -0.788 . . . . 0.0 111.603 169.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -51.12 -35.63 36.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.587 1.955 . . . . 0.0 111.213 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.1 ptt? -71.5 -32.77 68.6 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.566 1.076 . . . . 0.0 111.614 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.43 -48.2 73.56 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.21 -41.67 79.87 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 122.485 0.314 . . . . 0.0 110.341 178.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.26 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.737 0.815 . . . . 0.0 110.319 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.3 t -61.99 -44.38 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.077 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.91 -49.62 76.74 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.724 0.693 . . . . 0.0 110.493 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -63.34 -41.61 98.88 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 119.559 -0.258 . . . . 0.0 110.482 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.2 t -60.92 -49.98 75.26 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.193 0.597 . . . . 0.0 109.621 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.14 -45.66 90.87 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -60.69 -47.92 84.09 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.58 -36.52 78.84 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.75 -0.594 . . . . 0.0 111.409 -177.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 61.2 m -59.04 -48.2 82.46 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.748 0.819 . . . . 0.0 110.631 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 36.2 mt -53.82 -50.71 65.57 Favored 'General case' 0 C--N 1.342 0.264 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 174.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.6 m -55.77 -37.91 69.18 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.677 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -70.81 -55.71 7.94 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.169 1.349 . . . . 0.0 110.141 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -74.25 -29.85 61.87 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.821 -170.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.415 HD21 ' HB1' ' A' ' 113' ' ' ALA . 16.2 tp -88.71 -34.72 17.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.107 0.563 . . . . 0.0 111.388 -174.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.289 0.0 OUTLIER 41.04 48.82 2.96 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.887 1.675 . . . . 0.0 112.684 -173.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -136.83 179.63 6.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.043 2.137 . . . . 0.0 106.402 169.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -70.53 14.67 0.12 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.278 25.3 m 44.49 40.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 127.122 2.169 . . . . 0.0 112.142 -173.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.15 165.72 24.51 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.391 0.677 . . . . 0.0 111.093 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -46.37 -51.61 14.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.429 1.892 . . . . 0.0 112.904 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -67.29 -41.38 85.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.139 0.427 . . . . 0.0 110.275 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.415 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -64.45 -34.96 79.42 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.646 -0.659 . . . . 0.0 110.523 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.459 HD22 HD21 ' A' ' 75' ' ' LEU . 3.5 mp -64.87 -46.97 79.56 Favored 'General case' 0 CA--C 1.521 -0.172 0 O-C-N 121.269 -0.894 . . . . 0.0 110.895 172.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.7 tp -55.2 -37.16 66.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.404 0.682 . . . . 0.0 111.081 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -70.37 -18.81 63.06 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.43 25.14 4.46 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.649 1.113 . . . . 0.0 113.014 -174.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -41.21 -47.35 3.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.467 1.507 . . . . 0.0 112.419 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.92 -39.43 94.16 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.037 0.835 . . . . 0.0 111.903 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.06 -43.75 98.34 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.2 tp -57.95 -49.37 77.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.977 0.911 . . . . 0.0 110.684 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -55.83 -47.63 76.89 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.483 0.583 . . . . 0.0 109.61 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.2 mt -67.57 -35.91 79.92 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.291 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.8 90.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.732 0.696 . . . . 0.0 109.85 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.6 t -57.44 -43.84 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 118.801 0.728 . . . . 0.0 109.648 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.07 3.82 3.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.139 0.976 . . . . 0.0 113.611 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -120.34 -27.13 5.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.605 1.562 . . . . 0.0 110.988 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.97 -39.7 77.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.255 0.934 . . . . 0.0 108.851 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.23 157.93 43.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.837 0.827 . . . . 0.0 110.738 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -145.62 130.1 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.951 1.7 . . . . 0.0 106.744 169.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.65 32.42 53.95 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.377 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.59 19.82 76.72 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.377 1.088 . . . . 0.0 113.662 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 72.4 t -124.64 139.56 50.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 174.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.18 135.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.346 0.593 . . . . 0.0 110.092 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -116.82 -42.24 2.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.714 1.606 . . . . 0.0 108.354 -173.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -147.86 152.1 37.05 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -131.5 -12.68 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.693 1.197 . . . . 0.0 111.428 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.76 117.04 62.07 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.337 0.971 . . . . 0.0 108.638 169.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.36 -31.68 27.66 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.24 1.96 . . . . 0.0 112.152 -172.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -44.38 85.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.614 -0.679 . . . . 0.0 109.319 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.89 -38.79 92.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.635 0.652 . . . . 0.0 110.544 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.6 t -56.71 -52.31 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 118.86 0.754 . . . . 0.0 109.366 173.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.9 t -63.14 -38.53 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.966 0.803 . . . . 0.0 110.499 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.2 -39.75 93.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.153 0.888 . . . . 0.0 110.822 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -64.34 -46.01 85.33 Favored 'General case' 0 CA--C 1.526 0.034 0 CA-C-N 118.723 0.692 . . . . 0.0 110.543 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.96 -40.69 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 118.904 0.774 . . . . 0.0 109.618 177.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.04 -33.74 72.35 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.569 0.748 . . . . 0.0 112.1 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 30.9 mt -72.64 -32.7 66.1 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.062 0.945 . . . . 0.0 111.936 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 . . . . . 0 C--O 1.25 1.088 0 CA-C-N 118.336 0.517 . . . . 0.0 109.898 178.08 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 . . . . . 0 C--O 1.235 0.339 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.1 p -74.7 -34.81 62.7 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.9 t -132.03 139.98 49.01 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -106.85 -30.11 9.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.705 176.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.19 167.48 26.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.83 1.196 . . . . 0.0 111.847 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.5 mt -139.45 135.22 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 172.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.15 154.6 49.17 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.483 HG22 HD11 ' A' ' 75' ' ' LEU . 39.7 mt -139.61 120.42 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.669 -2.715 . . . . 0.0 103.669 169.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.12 143.57 48.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.613 0.765 . . . . 0.0 109.459 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -67.61 168.74 10.56 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 168.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -14.71 61.96 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.1 0.96 . . . . 0.0 112.244 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -74.63 -9.52 58.65 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.139 0.975 . . . . 0.0 112.207 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.24 52.89 9.8 Favored Glycine 0 C--N 1.341 0.849 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -172.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -136.92 131.44 33.07 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.633 1.173 . . . . 0.0 109.306 -173.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -59.66 107.23 0.57 Allowed 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.868 0.867 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 mt -73.83 -37.34 64.88 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 155.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -143.2 148.92 37.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.615 1.566 . . . . 0.0 107.851 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.89 141.89 10.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.4 OUTLIER -149.35 148.28 29.32 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.607 1.563 . . . . 0.0 107.714 176.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.43 152.24 46.9 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.711 1.604 . . . . 0.0 108.056 -173.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -136.12 -4.21 2.17 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.214 1.005 . . . . 0.0 112.581 -174.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -134.2 158.53 43.47 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.12 0.873 . . . . 0.0 110.037 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.4 2.05 6.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.144 2.177 . . . . 0.0 112.747 -172.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 p -59.71 -48.44 81.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.65 1.18 . . . . 0.0 110.431 174.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -145.16 75.61 13.85 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.5 1.12 . . . . 0.0 108.704 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -90.36 -0.99 5.38 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.714 2.276 . . . . 0.0 113.695 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -135.51 140.13 44.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 119.14 0.882 . . . . 0.0 109.943 -169.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.3 t -45.41 -50.4 3.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.532 1.933 . . . . 0.0 113.062 -169.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -57.9 -48.72 79.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.545 0.611 . . . . 0.0 110.927 -176.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.91 -35.13 72.15 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -63.29 -51.2 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.592 0.757 . . . . 0.0 110.924 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -62.01 -32.61 73.11 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.026 -1.046 . . . . 0.0 111.246 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.88 71.77 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.3 -38.96 88.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.998 0.919 . . . . 0.0 111.513 178.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -61.0 -48.96 79.4 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.046 1.738 . . . . 0.0 110.59 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -68.76 -35.43 77.07 Favored 'General case' 0 N--CA 1.463 0.175 0 O-C-N 121.75 -0.594 . . . . 0.0 110.903 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -47.83 76.9 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.536 0.734 . . . . 0.0 110.553 169.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.4 mt -61.56 -47.34 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.278 0.631 . . . . 0.0 109.703 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -60.42 -47.09 87.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.631 0.65 . . . . 0.0 109.961 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -54.58 -48.02 72.61 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.059 0.943 . . . . 0.0 111.524 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.8 mmmt -69.97 -49.36 52.47 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.306 0.642 . . . . 0.0 110.016 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 39.2 p -70.3 -27.46 64.41 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.638 -0.664 . . . . 0.0 111.818 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -62.14 -17.96 59.46 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.895 0.77 . . . . 0.0 111.943 170.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -117.59 25.04 10.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.313 1.845 . . . . 0.0 110.036 -175.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.8 m -132.55 158.22 42.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.841 1.656 . . . . 0.0 107.608 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.82 -41.8 98.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.1 m 141.89 -174.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 1 C-N-CA 132.531 4.332 . . . . 0.0 108.633 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.335 10.1 pt-20 61.08 -47.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 131.366 3.866 . . . . 0.0 116.859 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.61 152.54 10.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 120.198 1.363 . . . . 0.0 109.871 -175.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.79 165.18 31.33 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.404 1.882 . . . . 0.0 108.72 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -134.42 104.42 6.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 103.132 -2.914 . . . . 0.0 103.132 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -67.48 -63.09 1.13 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.358 -169.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -149.34 1.75 0.54 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.394 2.278 . . . . 0.0 110.308 -174.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.39 -35.95 1.21 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.03 1.776 . . . . 0.0 109.962 -171.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.0 mt -72.07 125.35 27.05 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 170.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 m -82.04 141.57 33.08 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.6 t -131.23 137.18 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.96 135.87 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -157.85 171.17 20.78 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.593 0.711 . . . . 0.0 112.072 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.9 tttp -153.94 157.08 38.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.026 1.73 . . . . 0.0 106.788 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -137.71 133.07 33.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -152.98 144.03 23.03 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.152 0.581 . . . . 0.0 110.401 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 mt 65.0 -84.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.403 1.881 . . . . 0.0 109.475 173.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -150.82 21.07 0.79 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.818 1.647 . . . . 0.0 109.52 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.483 HD11 HG22 ' A' ' 18' ' ' ILE . 21.9 tp -125.77 147.25 49.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 126.787 2.035 . . . . 0.0 110.144 -168.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -129.38 134.64 47.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -123.75 138.62 54.48 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.148 1.379 . . . . 0.0 107.501 -169.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -144.8 150.3 36.93 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.643 1.11 . . . . 0.0 112.099 -170.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.0 t -137.26 140.7 41.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 127.441 2.296 . . . . 0.0 104.953 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -131.14 135.87 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 -177.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.47 175.74 30.97 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-O 122.802 1.223 . . . . 0.0 112.502 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.9 m -61.21 154.17 24.16 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 112.599 -1.8 . . . . 0.0 110.639 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.4 m -57.01 -39.11 74.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.327 0.651 . . . . 0.0 109.881 171.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 5.9 t80 48.98 -143.59 0.48 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.689 1.996 . . . . 0.0 110.683 169.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.47 6.73 6.31 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.157 1.383 . . . . 0.0 111.625 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -159.19 163.19 36.21 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.489 1.516 . . . . 0.0 109.049 174.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -120.89 -6.87 9.56 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.436 2.294 . . . . 0.0 110.472 175.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.2 mt -57.17 -35.33 69.43 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 125.832 1.653 . . . . 0.0 110.655 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -65.06 -34.16 77.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.582 0.628 . . . . 0.0 111.912 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -73.51 -40.88 63.7 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.8 -45.57 70.8 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.982 . . . . 0.0 110.373 169.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.41 75.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.257 1.023 . . . . 0.0 110.387 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.5 t -61.34 -44.56 98.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 C-N-CA 123.3 0.64 . . . . 0.0 110.006 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.4 tp -60.15 -48.99 79.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.2 0.455 . . . . 0.0 110.274 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -61.37 -44.82 96.51 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 119.47 -0.3 . . . . 0.0 110.4 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 94.6 m -62.5 -45.53 92.57 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 118.885 -0.579 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.6 tp -65.95 -46.19 79.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.195 0.907 . . . . 0.0 110.819 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -64.16 -41.99 96.92 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 117.981 0.355 . . . . 0.0 110.799 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.76 -39.55 84.14 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.571 -0.705 . . . . 0.0 110.801 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.1 m -59.8 -48.05 83.25 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.323 0.649 . . . . 0.0 110.734 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -52.88 -48.86 66.83 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -60.24 -27.13 66.96 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.355 -0.831 . . . . 0.0 113.028 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.5 mm-40 -81.9 -53.33 6.25 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 120.12 1.327 . . . . 0.0 110.771 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -78.75 -33.79 46.27 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -168.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.56 -43.87 68.58 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.304 0.956 . . . . 0.0 109.104 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? 49.61 51.53 16.28 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.817 1.247 . . . . 0.0 110.048 -169.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -137.49 -171.37 2.96 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.762 2.425 . . . . 0.0 106.875 176.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -77.38 5.84 8.0 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.273 0.629 . . . . 0.0 112.113 175.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.324 4.8 m 49.2 40.34 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 126.91 2.084 . . . . 0.0 112.204 -174.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.27 168.83 18.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.128 0.971 . . . . 0.0 110.205 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -49.16 -48.23 45.1 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.605 1.162 . . . . 0.0 112.591 -176.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -66.4 -39.95 89.33 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 118.644 -0.694 . . . . 0.0 110.341 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.34 -36.88 85.17 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.201 0.91 . . . . 0.0 110.487 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.99 -47.06 78.89 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.769 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.3 tp -56.67 -38.06 71.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.69 0.677 . . . . 0.0 111.331 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.62 -19.08 64.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.03 0.932 . . . . 0.0 112.887 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -131.75 24.77 4.69 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.105 0.962 . . . . 0.0 111.561 -169.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -47.88 -47.66 31.7 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.917 1.287 . . . . 0.0 111.472 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -66.93 -36.34 82.02 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.241 0.473 . . . . 0.0 111.416 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.44 96.51 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.1 -49.07 79.09 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.685 1.194 . . . . 0.0 111.096 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -54.11 -48.42 70.76 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.983 0.811 . . . . 0.0 110.362 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 71.9 mt -68.43 -34.85 76.73 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.097 -0.478 . . . . 0.0 111.526 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.9 -44.94 83.79 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.925 0.784 . . . . 0.0 109.867 175.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.6 t -56.61 -45.29 82.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.8 -5.92 10.37 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.867 1.267 . . . . 0.0 113.686 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -112.3 -18.39 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 111.774 174.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 80.9 mt -81.4 -41.64 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.487 1.04 . . . . 0.0 108.467 172.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.9 p -145.0 148.11 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.267 1.027 . . . . 0.0 109.003 -169.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -146.89 136.44 22.93 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.8 29.58 50.41 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.928 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.68 14.86 81.69 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 118.171 0.986 . . . . 0.0 113.627 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.72 125.99 73.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.1 pt -57.93 145.72 8.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.3 pp -133.99 -13.33 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.022 0.929 . . . . 0.0 111.875 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -149.14 157.41 43.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.136 0.88 . . . . 0.0 108.964 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.7 p -143.93 31.06 1.28 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.809 1.643 . . . . 0.0 109.96 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -134.63 114.04 12.09 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 125.08 1.352 . . . . 0.0 107.897 178.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.82 -31.49 10.22 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.308 2.005 . . . . 0.0 112.16 -170.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -66.64 -45.38 79.21 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -71.98 -30.55 65.37 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.214 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.6 t -57.07 -54.62 27.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.612 1.096 . . . . 0.0 108.451 169.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.18 -36.18 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 119.159 0.89 . . . . 0.0 111.275 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -55.77 -49.82 72.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.134 0.879 . . . . 0.0 109.989 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -63.01 -40.66 98.44 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.407 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 69.3 t -59.37 -43.54 90.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.778 1.172 . . . . 0.0 109.935 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.7 75.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.307 0.643 . . . . 0.0 111.674 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.23 -37.39 80.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 125.966 1.706 . . . . 0.0 111.622 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 . . . . . 0 C--O 1.249 1.047 0 C-N-CA 123.999 0.919 . . . . 0.0 109.817 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 . . . . . 0 C--O 1.236 0.366 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 36.1 p -72.35 -31.65 65.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 173.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 m -136.44 139.81 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 123.64 0.776 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -91.94 -36.01 13.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.183 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.27 167.25 24.24 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.239 0.927 . . . . 0.0 112.541 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.7 mt -135.32 135.7 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 104.789 -2.301 . . . . 0.0 104.789 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 mt -133.92 151.93 51.67 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.5 mt -139.72 120.21 14.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 169.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 mt -123.76 144.5 49.65 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -172.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 168.41 9.61 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.401 170.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -71.68 10.46 0.66 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.665 1.186 . . . . 0.0 113.881 -174.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.99 5.17 5.94 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.64 1.576 . . . . 0.0 110.621 169.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 6.02 58.25 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 125.286 1.422 . . . . 0.0 113.203 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -69.83 132.42 46.01 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.426 1.613 . . . . 0.0 109.865 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -60.21 123.75 18.18 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.3 mt -100.11 -41.27 7.2 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 162.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -147.86 152.12 37.08 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.431 0.692 . . . . 0.0 109.6 172.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.08 146.63 18.99 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 169.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -146.39 145.19 30.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 172.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -134.67 148.65 50.39 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 125.621 1.569 . . . . 0.0 106.855 -177.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -130.41 7.14 4.9 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.267 1.027 . . . . 0.0 110.684 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -133.66 147.38 51.42 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.081 0.952 . . . . 0.0 110.674 -170.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.61 -7.51 33.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.163 1.785 . . . . 0.0 114.483 -169.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.9 p -67.04 -35.29 79.57 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.646 1.112 . . . . 0.0 112.618 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -141.36 63.51 17.7 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 119.323 0.965 . . . . 0.0 111.231 -174.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -86.69 -1.39 8.21 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.98 2.454 . . . . 0.0 113.314 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.2 m -134.73 140.49 45.99 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.086 0.955 . . . . 0.0 109.511 -169.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.2 t -44.52 -52.63 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 126.338 1.855 . . . . 0.0 112.955 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.87 -43.24 98.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.683 0.674 . . . . 0.0 111.193 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.57 -33.97 64.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.4 -50.01 75.28 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-O 118.691 -0.671 . . . . 0.0 109.726 172.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -57.52 -37.2 72.64 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.176 0.898 . . . . 0.0 111.405 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.25 -50.13 72.96 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.313 0.645 . . . . 0.0 109.508 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.4 -37.48 87.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.847 0.459 . . . . 0.0 111.578 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.48 -45.74 91.64 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.131 1.772 . . . . 0.0 110.537 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.87 -42.94 97.39 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.903 -0.498 . . . . 0.0 109.993 175.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.0 -49.96 70.2 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.214 0.606 . . . . 0.0 110.888 173.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -58.05 -51.77 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.061 0 C-N-CA 123.974 0.91 . . . . 0.0 108.766 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -60.64 -47.91 84.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.371 0.532 . . . . 0.0 110.702 -174.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -56.65 -50.6 71.57 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 122.889 0.476 . . . . 0.0 110.855 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -64.83 -46.75 80.65 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.3 p -71.03 -32.62 69.42 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.669 -0.644 . . . . 0.0 111.822 -174.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -62.72 -12.73 25.71 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.368 -0.833 . . . . 0.0 111.701 170.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -122.34 25.02 9.12 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.063 1.745 . . . . 0.0 109.754 -175.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 99.2 m -133.06 161.64 33.84 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.834 1.653 . . . . 0.0 108.505 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -87.47 25.34 1.45 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.441 1.496 . . . . 0.0 113.426 -169.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.478 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 7.2 m 69.05 178.92 0.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.79 1.636 . . . . 0.0 113.728 176.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.6 pt-20 55.96 -46.56 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 131.107 3.763 . . . . 0.0 116.706 -174.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.8 tt -149.78 156.81 6.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 120.278 1.399 . . . . 0.0 109.62 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.87 158.29 43.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.479 1.912 . . . . 0.0 108.392 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -121.89 99.24 6.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 101.754 -3.424 . . . . 0.0 101.754 169.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.41 -62.3 1.61 Allowed 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 123.64 0.776 . . . . 0.0 112.217 -168.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -149.44 4.96 0.61 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.582 1.953 . . . . 0.0 110.783 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 142.75 -35.39 1.71 Allowed Glycine 0 CA--C 1.528 0.852 0 C-N-CA 126.353 1.93 . . . . 0.0 108.817 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.35 133.51 47.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.322 1.049 . . . . 0.0 108.418 169.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.3 m -90.2 144.11 26.16 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.6 t -136.54 137.89 47.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.3 m -119.92 146.18 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.478 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 25.7 p90 -157.74 160.27 37.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.091 0.472 . . . . 0.0 110.848 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -148.16 174.59 11.81 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.137 0.975 . . . . 0.0 108.63 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.7 p -140.57 145.46 36.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 171.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -146.79 142.29 27.58 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.69 0.796 . . . . 0.0 109.341 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.6 mp 53.03 -84.29 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.155 2.182 . . . . 0.0 111.454 -174.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -149.85 30.76 0.72 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.415 1.886 . . . . 0.0 109.06 -176.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.6 tp -137.83 148.18 45.22 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.203 1.401 . . . . 0.0 109.774 -169.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -124.9 146.55 49.27 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.926 0.891 . . . . 0.0 108.95 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -135.69 142.97 45.17 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.41 1.484 . . . . 0.0 107.96 -171.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -147.53 151.07 35.7 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.023 0.929 . . . . 0.0 111.258 -170.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -139.8 141.16 34.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 169.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.91 135.49 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 -173.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -167.71 -176.75 38.61 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-O 121.984 0.769 . . . . 0.0 113.532 -178.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.9 m -62.41 161.19 12.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.703 1.601 . . . . 0.0 111.605 -176.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.8 p -126.37 13.67 7.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.007 1.323 . . . . 0.0 111.966 -170.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 2.1 p90 -54.79 -50.4 68.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.772 1.629 . . . . 0.0 113.416 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -147.33 -23.3 0.39 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -172.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.64 155.35 38.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.097 0.862 . . . . 0.0 110.395 -170.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.12 -8.33 7.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.921 2.088 . . . . 0.0 110.68 175.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.415 HD12 ' H ' ' A' ' 88' ' ' LEU . 4.4 mp -58.2 -33.93 69.83 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.975 1.31 . . . . 0.0 110.935 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -65.66 -33.84 76.82 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.906 0.775 . . . . 0.0 111.459 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 36.9 mt -70.42 -46.49 63.83 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.1 mmt -55.54 -40.44 71.87 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.305 173.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.76 71.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.847 0.859 . . . . 0.0 110.04 -178.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.61 -45.02 99.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 118.33 0.513 . . . . 0.0 110.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.97 -49.27 78.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.422 0.556 . . . . 0.0 110.312 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -63.52 -43.59 96.72 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.337 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 96.8 m -61.71 -45.32 94.46 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.32 -45.89 78.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.45 1.023 . . . . 0.0 110.861 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -62.41 -43.33 99.07 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.429 0.633 . . . . 0.0 110.997 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.22 -37.33 72.05 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.346 -0.846 . . . . 0.0 110.947 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -60.53 -48.54 81.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.512 0.597 . . . . 0.0 110.587 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.4 mt -50.72 -51.23 51.9 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 173.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -55.0 -42.61 72.72 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.872 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -69.42 -48.72 60.12 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 119.577 1.08 . . . . 0.0 111.777 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 11.6 ptt? -73.6 -28.72 61.97 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.459 1.027 . . . . 0.0 112.003 -174.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 21.1 tp -85.4 -35.02 21.59 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -171.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 52.26 28.88 6.01 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.307 1.443 . . . . 0.0 113.765 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -153.59 -178.25 6.89 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.235 1.814 . . . . 0.0 106.89 169.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -48.07 131.89 15.71 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.895 0.878 . . . . 0.0 109.195 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 29.9 m -79.99 38.95 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 124.733 1.213 . . . . 0.0 110.22 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -78.2 171.39 15.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.613 1.165 . . . . 0.0 111.772 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -44.88 -61.21 1.69 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.079 1.752 . . . . 0.0 112.667 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -61.93 -41.43 97.94 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.949 -0.469 . . . . 0.0 110.337 -179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.31 -31.54 67.55 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.822 -0.549 . . . . 0.0 112.098 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -77.76 -32.99 52.93 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.09 -1.006 . . . . 0.0 109.96 173.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.53 -33.88 71.95 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.736 0.698 . . . . 0.0 110.923 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -71.15 -17.83 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.27 -0.894 . . . . 0.0 113.265 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -129.98 28.44 5.06 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.453 1.024 . . . . 0.0 112.789 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.76 -48.14 2.17 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.921 1.688 . . . . 0.0 112.722 174.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.94 -37.9 89.17 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.111 0.869 . . . . 0.0 111.725 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.96 -43.51 95.84 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 176.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.25 -49.04 78.53 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.98 0.912 . . . . 0.0 110.879 173.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.08 -48.32 76.33 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.513 0.597 . . . . 0.0 109.396 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.75 -37.08 85.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.177 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.44 95.73 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.916 0.78 . . . . 0.0 110.593 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.8 t -60.38 -45.62 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 118.906 0.775 . . . . 0.0 109.09 174.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -73.49 18.2 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.064 1.346 . . . . 0.0 112.991 176.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -135.54 -25.67 1.29 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.665 1.586 . . . . 0.0 110.757 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.71 -29.09 8.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.356 1.062 . . . . 0.0 109.552 171.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.8 t -138.04 147.5 25.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 119.685 1.129 . . . . 0.0 108.638 -171.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -144.28 126.19 15.34 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 125.473 1.509 . . . . 0.0 107.366 169.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.9 32.29 59.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 119.431 -0.649 . . . . 0.0 113.657 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.76 12.52 84.43 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.264 1.032 . . . . 0.0 113.672 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.9 t -121.13 141.26 42.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 30.3 pt -55.17 140.26 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-O 121.959 0.885 . . . . 0.0 110.049 174.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -113.66 -44.22 3.22 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 126.621 1.968 . . . . 0.0 107.512 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -145.74 161.84 38.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.0 m -148.19 38.69 0.89 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.193 0.997 . . . . 0.0 110.679 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -132.95 117.44 14.94 Favored Pre-proline 0 C--O 1.235 0.335 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.65 -42.93 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.077 1.851 . . . . 0.0 113.01 -169.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.257 1.9 pp0? -69.38 -27.53 65.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.938 -1.101 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.58 -43.53 69.24 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 119.628 1.103 . . . . 0.0 109.741 175.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 11.7 t -52.46 -49.91 41.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 170.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.6 t -63.2 -39.28 84.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.697 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -57.57 -51.1 70.86 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 119.515 1.052 . . . . 0.0 109.273 175.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -62.56 -40.67 97.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.636 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.67 -43.3 96.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 120.071 1.305 . . . . 0.0 109.632 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.22 79.16 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.211 0.604 . . . . 0.0 111.512 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.31 -39.28 78.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.036 1.734 . . . . 0.0 111.974 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.139 1.376 . . . . 0.0 110.095 -176.178 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 . . . . . 0 C--O 1.235 0.334 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -63.98 -34.8 78.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.055 0.942 . . . . 0.0 110.186 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -157.13 160.6 2.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -174.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -123.06 -40.0 2.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.947 1.299 . . . . 0.0 110.088 -175.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.97 168.8 23.84 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.432 0.56 . . . . 0.0 111.179 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.4 mt -137.4 137.1 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 105.282 -2.118 . . . . 0.0 105.282 173.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -134.29 150.23 50.97 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.2 mt -137.19 120.09 20.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 169.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.7 mt -124.13 143.04 50.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -170.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.46 168.47 8.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.475 170.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -72.4 13.82 0.3 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.643 1.177 . . . . 0.0 113.794 -174.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -131.32 6.34 4.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.883 1.673 . . . . 0.0 110.327 169.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.87 5.96 59.55 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.397 1.475 . . . . 0.0 113.403 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -70.21 131.86 44.87 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 119.526 1.663 . . . . 0.0 109.918 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -60.64 118.79 7.01 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.51 -41.54 8.13 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 165.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -146.5 152.53 39.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.14 146.86 20.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 169.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -142.16 139.23 32.03 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 171.606 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -127.56 147.84 50.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 174.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -129.23 8.84 5.59 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.125 0.57 . . . . 0.0 110.571 -177.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -141.05 152.25 44.69 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.431 0.692 . . . . 0.0 111.81 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.68 -7.76 23.04 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.371 1.868 . . . . 0.0 113.962 -174.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 p -58.91 -42.73 90.33 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.149 -0.969 . . . . 0.0 112.157 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -145.16 72.26 14.6 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 119.079 0.854 . . . . 0.0 109.925 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -90.34 -1.17 5.39 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.811 2.341 . . . . 0.0 113.35 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.3 m -132.44 137.09 47.15 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.567 -169.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.4 t -46.87 -48.37 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.299 1.84 . . . . 0.0 112.683 -169.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -57.5 -48.0 80.41 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.417 0.553 . . . . 0.0 111.024 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -74.31 -33.35 63.17 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -61.34 -51.3 69.43 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.066 0.546 . . . . 0.0 110.714 174.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -61.49 -32.31 72.32 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.054 -1.029 . . . . 0.0 111.215 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -48.43 72.26 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -61.34 -38.43 86.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.406 0.683 . . . . 0.0 111.195 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.33 -44.94 93.48 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.41 1.484 . . . . 0.0 111.15 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -43.59 98.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.155 0.434 . . . . 0.0 109.84 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.29 -48.48 74.02 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.634 0.773 . . . . 0.0 110.946 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -59.27 -53.37 49.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -60.17 -44.85 94.71 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.648 0.379 . . . . 0.0 110.624 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -61.95 -47.61 84.11 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.278 0.631 . . . . 0.0 111.489 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -74.48 -48.66 25.95 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 122.787 0.435 . . . . 0.0 110.355 -170.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 p -59.18 -35.35 73.41 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.264 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -54.16 -26.76 29.65 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -77.91 -16.94 57.83 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 119.05 0.841 . . . . 0.0 112.778 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.7 p -78.33 173.24 12.53 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.364 0.984 . . . . 0.0 111.4 -174.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.22 -5.22 48.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.303 1.041 . . . . 0.0 112.125 169.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 m 77.77 143.51 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.547 2.739 . . . . 0.0 113.762 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 127.29 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 1 C-N-CA 133.338 4.655 . . . . 0.0 108.703 172.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.0 tt -154.42 157.3 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.698 1.199 . . . . 0.0 109.002 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.04 166.73 27.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.693 2.397 . . . . 0.0 107.98 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 tp -130.05 112.24 13.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 174.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -84.23 -165.52 1.18 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.04 1.336 . . . . 0.0 108.962 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.89 19.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.339 2.256 . . . . 0.0 114.369 -173.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.96 -3.0 0.47 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.559 1.552 . . . . 0.0 112.621 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.3 mt -126.32 131.98 51.72 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 118.353 1.076 . . . . 0.0 109.525 -170.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.0 m -75.68 141.61 42.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 84.5 t -137.97 117.94 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -98.2 146.23 8.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 169.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -155.66 162.72 40.54 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.989 0.359 . . . . 0.0 111.136 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -148.4 176.03 10.63 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.205 1.002 . . . . 0.0 108.636 170.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.6 p -141.26 148.6 40.09 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 m -144.7 141.87 29.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.0 mt 62.74 -78.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 126.879 2.072 . . . . 0.0 111.13 170.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -156.9 34.59 0.3 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.668 1.987 . . . . 0.0 108.931 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.5 tp -145.13 149.67 35.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.099 1.36 . . . . 0.0 109.784 -169.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -126.51 148.68 49.67 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.53 1.132 . . . . 0.0 109.231 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -137.34 140.55 41.55 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 125.378 1.471 . . . . 0.0 107.968 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -145.13 149.03 34.28 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 123.948 0.899 . . . . 0.0 110.501 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 96.5 t -136.32 136.54 48.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 169.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -127.44 137.77 56.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 -170.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -158.24 -177.39 31.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-O 121.742 0.635 . . . . 0.0 112.11 -176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 m -58.76 158.12 8.53 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.136 1.374 . . . . 0.0 112.188 -174.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 p -74.46 38.5 0.12 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.458 1.903 . . . . 0.0 111.058 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -69.05 167.93 14.94 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.978 1.311 . . . . 0.0 111.029 -171.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.69 -10.25 50.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.455 1.102 . . . . 0.0 113.375 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -148.01 171.19 16.22 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.903 1.281 . . . . 0.0 108.889 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.53 3.63 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.233 2.213 . . . . 0.0 110.76 -170.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.83 -31.68 72.78 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.472 1.109 . . . . 0.0 110.868 -173.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -33.44 75.82 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.871 0.759 . . . . 0.0 111.332 173.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.2 mt -71.19 -44.7 64.92 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.2 mmt -56.03 -41.0 74.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.282 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.39 -47.04 80.74 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.472 0.709 . . . . 0.0 110.3 -178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.1 t -62.01 -45.66 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-O 118.696 -0.668 . . . . 0.0 109.943 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 58.8 tp -61.21 -47.73 84.76 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.874 0.761 . . . . 0.0 110.331 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -64.56 -43.63 93.31 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.32 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 45.8 t -60.62 -50.61 72.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.268 0.627 . . . . 0.0 109.685 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.0 tp -61.97 -46.48 89.1 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.319 0.509 . . . . 0.0 110.992 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -64.67 -42.39 95.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.312 0.506 . . . . 0.0 111.046 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.73 -37.73 82.58 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 121.435 -0.791 . . . . 0.0 110.644 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.2 m -61.5 -46.73 88.77 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.664 0.785 . . . . 0.0 110.84 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.9 mt -54.72 -47.98 73.08 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.0 m -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.859 0.464 . . . . 0.0 111.879 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -73.12 -55.22 6.77 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.824 1.193 . . . . 0.0 109.69 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 67.0 mtm -66.03 -41.94 90.24 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.276 0.36 . . . . 0.0 111.751 -169.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.95 -35.86 77.26 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 118.041 0.382 . . . . 0.0 110.601 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.94 27.87 6.0 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.849 1.259 . . . . 0.0 112.455 -174.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -155.61 -175.34 5.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 126.739 2.016 . . . . 0.0 107.99 174.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.29 125.88 22.61 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.978 0.911 . . . . 0.0 108.789 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.3 m -77.95 46.73 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 125.371 1.468 . . . . 0.0 110.857 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.33 167.79 20.96 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.274 -0.891 . . . . 0.0 111.423 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -44.8 -54.17 6.64 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.104 1.762 . . . . 0.0 112.355 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -40.27 88.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.143 -0.348 . . . . 0.0 110.525 -176.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.5 -34.93 79.36 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.973 -0.455 . . . . 0.0 111.428 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.0 mp -67.87 -43.57 79.1 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 119.191 0.905 . . . . 0.0 110.46 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 69.7 tp -56.02 -37.26 68.95 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.28 0.491 . . . . 0.0 110.848 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -70.13 -18.81 63.24 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.279 1.032 . . . . 0.0 113.169 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -129.14 23.2 5.63 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.565 1.075 . . . . 0.0 111.442 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.65 -47.59 20.13 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.219 1.408 . . . . 0.0 111.832 -178.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -63.92 -39.73 94.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.941 0.791 . . . . 0.0 111.515 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.78 -43.6 95.97 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 tp -58.81 -50.44 73.95 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.287 1.035 . . . . 0.0 110.653 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -54.43 -49.03 70.94 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.481 0.712 . . . . 0.0 109.719 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.47 -33.87 76.01 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.601 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.94 80.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 118.859 0.754 . . . . 0.0 110.014 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 72.9 t -60.49 -41.04 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 118.658 0.663 . . . . 0.0 109.95 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.58 -24.83 67.96 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.402 0.681 . . . . 0.0 112.534 177.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -87.05 -34.73 19.08 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.576 -0.702 . . . . 0.0 110.683 177.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.86 -39.22 45.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.765 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 23.9 t -137.66 148.18 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 120.274 1.397 . . . . 0.0 111.851 -169.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -150.66 133.02 15.52 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.847 1.659 . . . . 0.0 108.033 169.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.66 24.99 54.84 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-O 119.487 -0.618 . . . . 0.0 114.632 173.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.07 18.33 69.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.379 1.09 . . . . 0.0 112.856 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.92 141.67 44.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.9 pt -70.55 154.96 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 119.684 -0.806 . . . . 0.0 109.859 176.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.6 mt -118.9 -19.28 8.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.029 1.331 . . . . 0.0 110.021 169.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -155.37 160.83 41.01 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 108.623 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -143.6 -5.98 0.81 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.558 1.143 . . . . 0.0 112.262 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.07 118.63 70.29 Favored Pre-proline 0 C--O 1.236 0.375 0 CA-C-N 119.735 1.152 . . . . 0.0 109.359 170.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -67.55 -30.94 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.902 1.735 . . . . 0.0 112.273 -174.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -64.64 -47.64 77.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -62.9 -38.69 91.94 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 118.392 0.542 . . . . 0.0 110.215 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.24 -58.49 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 30.1 m -67.0 -32.84 59.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.653 -173.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -61.13 -52.22 65.8 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.404 1.002 . . . . 0.0 109.987 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 80.0 mtt180 -61.52 -44.46 97.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 118.543 0.61 . . . . 0.0 110.091 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 15.2 t -58.45 -47.99 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.32 0.648 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.67 -29.92 56.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 122.681 0.392 . . . . 0.0 111.341 -171.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.27 -34.29 65.71 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.37 0.668 . . . . 0.0 111.108 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.1 mtm-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-N 118.375 0.534 . . . . 0.0 110.167 174.912 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 . . . . . 0 C--O 1.234 0.272 0 CA-C-O 119.752 -0.166 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.2 p -70.75 -32.09 69.13 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.408 0.683 . . . . 0.0 110.287 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.424 HG21 HG11 ' A' ' 129' ' ' VAL . 31.2 m -139.3 167.34 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.315 1.046 . . . . 0.0 109.173 -179.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -131.25 -27.94 1.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 117.369 -1.301 . . . . 0.0 110.591 173.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.77 165.66 29.98 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 120.179 1.354 . . . . 0.0 112.123 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.9 mt -135.03 136.85 51.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 169.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -133.57 149.75 51.64 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.5 mt -138.32 118.86 15.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 104.276 -2.49 . . . . 0.0 104.276 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 55.9 mt -122.71 144.92 48.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 -175.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.5 169.11 6.42 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.086 0.47 . . . . 0.0 110.519 169.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.78 -11.97 1.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.0 3.49 13.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.049 1.34 . . . . 0.0 110.743 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.16 6.41 55.69 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.09 1.328 . . . . 0.0 112.85 171.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.79 128.08 35.38 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 119.564 1.682 . . . . 0.0 109.869 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -60.9 120.83 10.93 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -101.96 -41.73 6.36 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 166.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -145.81 151.99 38.8 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.53 144.53 15.47 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 168.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -148.2 147.85 29.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -132.7 145.61 51.18 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -131.6 1.15 4.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.295 1.038 . . . . 0.0 111.493 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -134.05 162.62 31.59 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.925 0.89 . . . . 0.0 108.914 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -71.78 4.2 3.48 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.495 1.918 . . . . 0.0 113.611 -169.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -62.24 -48.5 79.66 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.445 1.098 . . . . 0.0 111.275 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -143.94 74.99 16.1 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 124.162 0.985 . . . . 0.0 108.989 -176.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.23 -1.88 6.96 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.582 2.188 . . . . 0.0 113.568 -172.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.6 m -134.22 139.21 45.63 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.098 0.959 . . . . 0.0 109.238 -169.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -43.73 -52.85 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.431 1.893 . . . . 0.0 112.98 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.99 -42.11 98.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.464 0.575 . . . . 0.0 111.28 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.27 -34.62 73.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -64.85 -49.81 69.08 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.289 0.635 . . . . 0.0 110.292 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.56 -35.69 70.66 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.449 -0.782 . . . . 0.0 111.033 177.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.44 -43.58 73.02 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.961 0.505 . . . . 0.0 109.932 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -62.43 -37.88 87.56 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.071 -0.393 . . . . 0.0 110.759 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -64.99 -43.12 93.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.72 1.608 . . . . 0.0 111.005 178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -59.27 -46.58 88.13 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.267 0.485 . . . . 0.0 109.86 172.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -46.67 83.58 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.731 0.812 . . . . 0.0 111.1 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.3 mm -57.43 -53.52 42.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 124.417 1.087 . . . . 0.0 108.344 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.46 -48.4 81.94 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.651 0.38 . . . . 0.0 110.366 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -56.95 -43.67 81.78 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.031 0.932 . . . . 0.0 111.911 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -76.36 -48.9 18.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.053 0.541 . . . . 0.0 109.937 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.9 p -65.96 -30.23 70.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.672 -0.642 . . . . 0.0 112.048 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -56.64 -24.42 48.09 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.486 -0.758 . . . . 0.0 111.782 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -110.64 21.41 16.6 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.31 1.444 . . . . 0.0 110.485 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.7 m -128.87 153.51 47.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.392 1.077 . . . . 0.0 109.322 -173.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -83.21 93.79 7.74 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.182 0.993 . . . . 0.0 109.048 176.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -45.4 140.85 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.468 1.907 . . . . 0.0 115.96 -171.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 144.73 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 1 C-N-CA 133.223 4.609 . . . . 0.0 107.231 170.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -151.92 156.93 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.833 1.253 . . . . 0.0 109.041 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 171.75 17.61 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.398 2.279 . . . . 0.0 107.559 173.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 tt -142.23 117.7 10.27 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.86 -1.904 . . . . 0.0 105.86 169.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 mp -111.94 103.75 11.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -169.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 61.34 -2.25 0.24 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.196 2.198 . . . . 0.0 115.324 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.8 -27.91 1.3 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 126.021 1.772 . . . . 0.0 111.33 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -85.77 132.64 34.09 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 118.314 1.057 . . . . 0.0 108.873 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 m -82.82 140.67 32.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 175.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 89.7 t -139.21 138.24 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -173.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.9 m -123.91 149.77 28.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -157.32 165.99 34.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.503 0.668 . . . . 0.0 111.876 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -151.16 159.6 44.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 127.305 2.242 . . . . 0.0 106.641 -169.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -138.42 144.45 40.18 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.7 m -138.74 119.65 14.34 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.039 1.336 . . . . 0.0 108.432 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.3 mp 62.58 -76.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 126.781 2.032 . . . . 0.0 113.061 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -143.39 21.84 1.86 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.607 1.563 . . . . 0.0 109.943 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.89 149.99 52.29 Favored 'General case' 0 N--CA 1.458 -0.075 0 C-N-CA 125.616 1.566 . . . . 0.0 109.387 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -130.4 142.18 50.52 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.983 1.313 . . . . 0.0 108.183 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -124.08 142.78 50.9 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.349 1.459 . . . . 0.0 107.087 -177.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -142.98 147.82 35.8 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.76 0.824 . . . . 0.0 109.251 -176.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.91 138.41 50.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.95 136.96 57.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 -172.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.07 -179.5 27.75 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-O 122.133 0.852 . . . . 0.0 112.192 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.4 m -59.62 165.89 2.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.696 1.599 . . . . 0.0 112.192 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -67.66 6.6 0.62 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.919 1.688 . . . . 0.0 114.541 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.29 122.94 17.85 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -175.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.16 -18.69 63.74 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.081 1.352 . . . . 0.0 114.555 -169.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -66.2 -32.43 73.86 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.705 -170.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.282 2.0 pp20? 48.39 -10.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.23 3.012 . . . . 0.0 118.463 -176.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 33.2 mt -63.8 -32.22 73.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 120.441 -1.412 . . . . 0.0 111.18 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -33.96 77.08 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.185 0.902 . . . . 0.0 111.532 174.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.3 mt -68.65 -47.35 66.77 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 19.2 mmt -55.4 -41.59 72.92 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.458 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.1 -51.69 66.92 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.282 0.633 . . . . 0.0 109.503 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.45 -44.81 99.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.223 0.465 . . . . 0.0 110.34 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.3 tp -61.31 -49.28 77.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.329 0.513 . . . . 0.0 110.471 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -65.21 -40.59 94.36 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.412 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.6 m -61.68 -46.94 87.56 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.442 0.565 . . . . 0.0 110.091 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.26 -51.35 66.52 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 118.55 0.613 . . . . 0.0 110.033 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -58.07 -47.18 83.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.215 0.606 . . . . 0.0 111.427 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -79.9 -29.21 39.83 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.474 -0.766 . . . . 0.0 111.894 -173.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.2 t -68.62 -43.55 76.11 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 119.249 0.931 . . . . 0.0 110.085 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 37.2 mt -53.33 -49.81 66.3 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 169.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.0 m -60.13 -32.01 70.61 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.22 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 35.3 mm-40 -65.82 -62.26 1.6 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 120.013 1.278 . . . . 0.0 109.513 174.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -72.65 -36.55 68.01 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -169.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.578 HD21 ' HB1' ' A' ' 113' ' ' ALA . 20.1 tp -73.88 -30.94 62.91 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.847 0.294 . . . . 0.0 111.352 -172.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 58.27 28.14 16.22 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.171 1.388 . . . . 0.0 113.08 172.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -150.15 176.56 10.73 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.935 2.094 . . . . 0.0 106.705 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -55.01 129.74 39.05 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.385 0.674 . . . . 0.0 109.719 169.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.419 HG12 HD23 ' A' ' 105' ' ' LEU . 24.5 m -81.5 48.06 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 109.727 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.11 176.74 4.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.124 -0.985 . . . . 0.0 111.737 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -46.84 -57.87 4.48 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.364 1.866 . . . . 0.0 112.836 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -64.8 -37.42 87.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.368 0.531 . . . . 0.0 110.674 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.578 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -68.26 -32.61 72.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.409 0.284 . . . . 0.0 110.879 -177.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.5 mp -75.02 -38.54 61.49 Favored 'General case' 0 CA--C 1.514 -0.404 0 O-C-N 120.594 -1.316 . . . . 0.0 111.821 172.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.7 tp -55.96 -39.28 71.55 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.48 0.582 . . . . 0.0 110.62 174.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -75.87 -10.57 59.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.33 24.93 4.16 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.726 1.148 . . . . 0.0 113.246 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -43.97 -44.9 7.51 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.042 1.337 . . . . 0.0 112.233 177.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.73 -40.73 95.82 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.042 0.837 . . . . 0.0 111.776 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.48 -42.95 98.82 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 176.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -55.75 -49.02 74.23 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.112 0.965 . . . . 0.0 110.449 172.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -58.03 -45.84 86.28 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.622 0.646 . . . . 0.0 109.851 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.09 -37.45 85.81 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 119.118 -0.468 . . . . 0.0 111.356 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.38 90.42 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 119.016 0.825 . . . . 0.0 110.096 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.97 -46.34 87.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.721 0.691 . . . . 0.0 109.746 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.7 -30.72 68.99 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.959 0.904 . . . . 0.0 112.661 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -85.79 -29.8 23.52 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.746 -0.596 . . . . 0.0 111.323 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 68.5 mt -78.99 -41.62 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.307 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . 0.424 HG11 HG21 ' A' ' 13' ' ' VAL . 0.9 OUTLIER -145.96 153.25 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 119.918 1.236 . . . . 0.0 110.836 -170.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -155.84 141.44 17.85 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.885 1.274 . . . . 0.0 108.799 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.61 25.08 54.85 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.423 -0.654 . . . . 0.0 114.125 173.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 86.35 8.81 77.24 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 118.077 0.939 . . . . 0.0 113.203 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.3 t -127.44 142.25 44.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 119.305 1.552 . . . . 0.0 106.953 -177.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -62.37 155.93 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.598 0.713 . . . . 0.0 110.33 171.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.6 mt -122.69 -23.41 5.12 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.919 1.688 . . . . 0.0 109.834 171.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -154.55 161.31 41.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.935 0.789 . . . . 0.0 109.315 173.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 9.1 p -144.74 34.17 1.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.406 1.482 . . . . 0.0 110.448 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.68 120.84 6.7 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.908 0.883 . . . . 0.0 109.924 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -64.73 -33.36 54.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.188 2.592 . . . . 0.0 114.608 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.292 2.5 pp0? -84.42 -27.38 27.63 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.09 0.859 . . . . 0.0 111.523 -176.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -68.74 -40.68 79.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.018 1.281 . . . . 0.0 108.755 168.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.3 t -55.09 -53.22 36.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 118.223 -0.894 . . . . 0.0 108.78 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.28 -37.12 79.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 119.966 1.257 . . . . 0.0 111.132 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 -48.44 81.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.584 0.629 . . . . 0.0 109.515 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -68.27 -34.74 76.73 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.853 0.751 . . . . 0.0 111.636 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 48.7 t -61.98 -43.81 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 119.182 0.901 . . . . 0.0 109.448 174.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.97 -32.12 73.14 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.506 0.594 . . . . 0.0 111.426 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 37.4 tp -73.16 -24.83 60.62 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.86 1.664 . . . . 0.0 112.293 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 . . . . . 0 C--O 1.25 1.123 0 CA-C-N 118.597 0.635 . . . . 0.0 110.257 172.728 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 . . . . . 0 C--O 1.235 0.334 0 CA-C-O 119.613 -0.232 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 32.4 p -71.34 -32.0 68.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 171.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.5 140.8 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -100.52 -25.25 14.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 117.513 -1.232 . . . . 0.0 109.787 171.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.1 167.77 23.72 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.768 1.167 . . . . 0.0 111.89 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mt -138.96 139.29 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mt -138.25 154.4 49.07 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.3 mt -138.05 120.46 18.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 103.814 -2.662 . . . . 0.0 103.814 168.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.9 mt -125.99 145.46 50.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -169.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 170.73 3.39 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.678 0.791 . . . . 0.0 110.905 170.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -63.48 2.33 0.44 Allowed 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -131.32 9.66 4.78 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.688 1.595 . . . . 0.0 110.738 175.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.09 19.97 48.22 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 118.645 -1.086 . . . . 0.0 113.095 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -78.34 132.68 37.52 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.778 1.789 . . . . 0.0 109.697 171.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 ttm180 -61.53 116.83 5.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.354 0.662 . . . . 0.0 109.673 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mt -85.53 -43.27 13.67 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 157.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -148.87 148.48 29.91 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.953 1.301 . . . . 0.0 108.188 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.03 146.7 14.41 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 3.3 mmpt? -141.28 149.14 40.88 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.65 1.58 . . . . 0.0 107.733 172.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -139.68 144.55 37.64 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.614 1.566 . . . . 0.0 107.596 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -135.0 -1.96 2.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.316 1.047 . . . . 0.0 112.041 -170.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -134.4 160.04 39.2 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.47 0.708 . . . . 0.0 109.447 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.95 3.89 4.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.846 2.059 . . . . 0.0 112.871 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -61.03 -47.62 85.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.663 1.185 . . . . 0.0 110.819 177.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -144.07 75.08 15.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.312 1.045 . . . . 0.0 108.888 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -90.03 -1.01 5.61 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.726 2.284 . . . . 0.0 113.687 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 m -134.34 137.87 44.49 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.017 0.927 . . . . 0.0 109.463 -169.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.7 t -46.09 -49.84 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.066 1.746 . . . . 0.0 112.866 -169.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.18 -47.68 82.67 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.559 0.618 . . . . 0.0 111.019 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -73.92 -32.47 63.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.148 0.431 . . . . 0.0 110.36 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -61.79 -51.15 69.45 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.089 0.555 . . . . 0.0 110.594 174.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.18 -35.55 75.62 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.354 -0.841 . . . . 0.0 110.85 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.53 78.59 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.57 -38.54 87.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 110.916 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.38 -42.75 99.66 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.465 1.506 . . . . 0.0 111.08 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -65.49 -41.97 92.66 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.583 0.629 . . . . 0.0 109.985 174.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.531 HD21 HD12 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -55.89 -46.16 78.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.052 0.541 . . . . 0.0 111.11 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.9 mm -60.56 -52.4 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -60.44 -46.01 91.6 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.742 0.701 . . . . 0.0 110.521 -177.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -55.66 -47.39 76.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.869 0.867 . . . . 0.0 111.628 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -67.69 -52.12 41.59 Favored 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 123.28 0.632 . . . . 0.0 110.227 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.401 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 36.2 p -70.7 -33.43 70.87 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.845 -0.534 . . . . 0.0 112.207 -169.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -64.71 -12.86 51.26 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.139 -0.976 . . . . 0.0 111.961 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -111.03 13.81 21.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.612 1.965 . . . . 0.0 111.361 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.8 m -120.33 159.48 24.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.556 1.142 . . . . 0.0 109.111 -176.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.24 31.84 0.45 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.675 1.59 . . . . 0.0 112.824 -169.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m 68.24 178.03 0.25 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.392 1.877 . . . . 0.0 113.603 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 11.1 pt-20 56.25 -44.05 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.415 3.886 . . . . 0.0 117.138 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -150.44 154.29 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 120.305 1.412 . . . . 0.0 109.259 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.15 163.8 36.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.839 2.056 . . . . 0.0 108.798 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.28 120.87 34.38 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.531 HD12 HD21 ' A' ' 47' ' ' ASN . 3.2 mm? -111.18 71.1 0.73 Allowed 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 126.167 1.787 . . . . 0.0 107.632 -172.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 62.84 7.95 2.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.533 1.533 . . . . 0.0 113.815 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 145.95 -33.91 1.47 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.327 1.918 . . . . 0.0 110.42 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.22 156.78 38.77 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.615 0.766 . . . . 0.0 109.141 170.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -117.06 138.77 51.39 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 77.8 t -136.33 139.31 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 -169.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.1 t -132.9 131.22 59.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.401 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 21.5 p90 -156.81 164.61 37.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -168.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 pttp -154.68 179.04 9.44 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.496 0.719 . . . . 0.0 109.232 169.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 p -138.34 146.06 41.89 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.4 m -147.9 146.03 28.88 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.461 1.104 . . . . 0.0 109.592 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 52.52 -83.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 127.03 2.132 . . . . 0.0 110.882 -172.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -152.81 29.43 0.52 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.82 2.048 . . . . 0.0 109.226 -176.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.2 tp -136.7 153.42 50.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.436 1.494 . . . . 0.0 110.27 -169.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -122.91 149.29 44.43 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.324 1.05 . . . . 0.0 109.125 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -136.89 141.56 42.75 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.587 1.555 . . . . 0.0 107.873 -172.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -145.18 150.24 36.39 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.074 0.95 . . . . 0.0 112.004 -169.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.4 t -137.19 138.74 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.51 137.91 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.7 -179.7 36.54 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.505 1.058 . . . . 0.0 113.006 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -172.94 0.67 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.595 -1.803 . . . . 0.0 109.658 175.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.8 t -142.35 161.34 38.27 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -155.23 -50.1 0.09 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.346 1.059 . . . . 0.0 109.285 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -150.4 -18.32 0.24 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.676 0.79 . . . . 0.0 111.828 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.456 HD22 ' C ' ' A' ' 86' ' ' ASN . 0.1 OUTLIER -155.48 171.74 19.41 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 123.823 0.849 . . . . 0.0 111.085 -175.208 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -1.4 14.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.729 2.412 . . . . 0.0 110.518 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.35 -32.69 68.77 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.733 1.213 . . . . 0.0 111.697 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -34.34 76.39 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.722 0.692 . . . . 0.0 111.274 177.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -69.45 -43.45 73.25 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 46.0 mmm -59.72 -40.11 86.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.348 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.84 76.9 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.766 0.827 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.26 -43.18 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 118.583 -0.722 . . . . 0.0 110.185 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 tp -60.85 -48.51 81.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.112 0.869 . . . . 0.0 110.477 178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -62.7 -46.4 88.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 119.341 -0.362 . . . . 0.0 110.317 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 89.7 m -60.61 -46.73 89.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.911 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.2 tp -61.01 -52.36 65.33 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 119.187 0.903 . . . . 0.0 111.024 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -66.01 -40.62 91.26 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.065 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.12 -31.58 66.16 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.497 -0.752 . . . . 0.0 111.311 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 71.0 m -62.58 -49.84 73.66 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.614 0.765 . . . . 0.0 110.312 172.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 74.8 mt -53.07 -46.64 68.66 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.3 m -58.68 -41.12 85.46 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 118.552 -0.737 . . . . 0.0 112.104 178.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -67.39 -42.04 83.99 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 119.828 1.195 . . . . 0.0 111.419 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.0 ptp -76.75 -36.22 57.24 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.14 0.882 . . . . 0.0 111.622 -175.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.85 -33.95 24.74 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 118.663 0.665 . . . . 0.0 112.015 -173.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 50.15 29.9 3.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.591 1.156 . . . . 0.0 112.822 -176.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -154.84 -178.07 6.96 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 126.316 1.847 . . . . 0.0 107.486 169.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -53.78 121.17 7.35 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.511 0.672 . . . . 0.0 111.104 176.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.1 m -79.32 50.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.373 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.98 175.99 6.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.041 0.936 . . . . 0.0 111.974 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -46.88 -56.56 6.12 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.369 1.468 . . . . 0.0 112.279 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -62.37 -44.47 96.4 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.137 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.69 83.76 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.501 0.591 . . . . 0.0 110.329 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.25 -38.04 75.05 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 118.498 -0.763 . . . . 0.0 112.081 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.24 -38.38 76.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.903 0.774 . . . . 0.0 110.831 176.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -72.04 -14.71 61.94 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -125.06 21.34 8.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.506 1.048 . . . . 0.0 111.923 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -48.37 -49.51 34.34 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.444 1.098 . . . . 0.0 112.215 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.49 -36.49 81.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.617 0.644 . . . . 0.0 111.361 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.15 -43.88 98.5 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 173.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -61.2 -49.34 77.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.68 1.192 . . . . 0.0 110.845 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -53.17 -49.96 65.59 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.131 0.878 . . . . 0.0 110.068 175.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 65.0 mt -65.89 -41.38 91.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 119.179 -0.439 . . . . 0.0 111.037 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.52 93.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.598 0.636 . . . . 0.0 110.294 178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.9 t -57.81 -44.39 86.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 118.288 0.495 . . . . 0.0 109.702 175.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -66.77 -5.75 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.606 1.162 . . . . 0.0 113.63 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -112.15 -28.81 7.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.017 1.327 . . . . 0.0 110.555 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 82.5 mt -66.97 -43.17 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.453 1.024 . . . . 0.0 108.723 171.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.45 155.19 28.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 124.303 1.041 . . . . 0.0 109.856 -174.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -149.67 131.44 15.06 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.221 1.408 . . . . 0.0 107.814 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.22 30.78 55.65 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 119.28 -0.733 . . . . 0.0 113.201 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.59 12.56 84.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 118.268 1.034 . . . . 0.0 113.846 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 t -123.72 141.41 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.155 1.478 . . . . 0.0 107.038 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.0 pt -55.71 138.7 15.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.456 0.646 . . . . 0.0 110.174 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -122.1 -38.8 2.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.126 1.77 . . . . 0.0 108.564 -172.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.55 153.39 43.52 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 169.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.3 m -133.37 28.21 4.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.216 1.407 . . . . 0.0 110.305 -169.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -139.22 125.72 12.52 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.229 1.012 . . . . 0.0 108.71 176.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.23 -38.39 3.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.843 2.362 . . . . 0.0 113.71 -171.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -28.11 57.58 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.032 -1.043 . . . . 0.0 110.433 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 68.0 mm-40 -61.8 -50.41 72.41 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.326 0.966 . . . . 0.0 109.748 169.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 12.3 t -51.98 -57.14 4.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 124.103 0.961 . . . . 0.0 109.02 177.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.5 t -63.56 -43.68 98.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.756 -173.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -57.36 -52.57 64.83 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 118.44 0.564 . . . . 0.0 109.643 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -57.32 -47.14 82.31 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.113 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 33.1 m -75.9 -28.47 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-N 120.385 1.448 . . . . 0.0 112.031 -172.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.96 -35.31 62.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.526 0.603 . . . . 0.0 110.981 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 52.6 tp -67.9 -41.2 83.07 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.961 1.704 . . . . 0.0 111.27 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 124.478 1.111 . . . . 0.0 110.03 -179.373 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 . . . . . 0 C--O 1.235 0.338 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.3 p -73.19 -23.14 60.37 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.886 -176.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.3 m -138.87 163.04 27.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 C-N-CA 123.906 0.882 . . . . 0.0 108.754 173.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -123.04 -28.12 4.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 117.247 -1.358 . . . . 0.0 110.166 171.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.82 165.31 30.47 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 120.094 1.315 . . . . 0.0 112.144 175.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.3 mt -133.23 133.8 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 170.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -131.19 146.46 52.34 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.5 mt -142.69 114.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 103.419 -2.808 . . . . 0.0 103.419 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.2 mt -124.89 148.1 48.48 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.419 0.688 . . . . 0.0 109.318 -169.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.79 170.55 13.38 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.915 169.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -60.26 -17.15 40.06 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -99.56 -14.31 19.08 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.647 1.112 . . . . 0.0 110.939 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.58 12.22 13.48 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 125.674 1.606 . . . . 0.0 112.239 175.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.93 132.04 47.14 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.158 1.479 . . . . 0.0 109.751 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -68.23 82.59 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.716 1.607 . . . . 0.0 109.853 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.42 -47.95 77.22 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -148.99 150.68 33.25 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.682 0.793 . . . . 0.0 109.116 171.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.29 145.74 19.48 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 169.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -147.95 148.07 30.37 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -134.21 144.65 48.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -130.04 0.44 4.73 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.169 0.988 . . . . 0.0 111.514 -172.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -133.8 161.78 33.79 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.671 0.788 . . . . 0.0 109.244 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -72.68 4.9 3.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.476 1.91 . . . . 0.0 113.071 -169.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.8 p -62.67 -48.77 77.88 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.713 1.205 . . . . 0.0 110.954 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -143.24 73.36 17.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.311 1.045 . . . . 0.0 109.026 -176.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -88.28 -1.47 6.91 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.727 2.285 . . . . 0.0 113.582 -171.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.5 m -133.29 138.13 46.29 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.213 1.005 . . . . 0.0 109.012 -170.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -45.4 -50.59 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 126.133 1.773 . . . . 0.0 112.999 -169.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -60.28 -43.96 95.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.724 0.693 . . . . 0.0 111.07 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -71.53 -33.5 69.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.049 0.386 . . . . 0.0 110.104 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -62.32 -49.6 74.98 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.073 0.549 . . . . 0.0 110.047 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.37 -37.78 75.94 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.309 -0.869 . . . . 0.0 111.137 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.38 77.65 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.978 0.511 . . . . 0.0 109.681 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -61.94 -37.53 85.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.117 0.567 . . . . 0.0 110.914 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -63.74 -42.81 97.8 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.455 1.502 . . . . 0.0 111.059 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -62.61 -43.42 98.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.316 0.962 . . . . 0.0 109.812 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.496 HD21 HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -56.71 -48.76 77.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.979 0.512 . . . . 0.0 110.983 175.424 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.83 -51.99 63.46 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 C-N-CA 124.149 0.98 . . . . 0.0 108.969 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -59.34 -47.16 86.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.185 0.594 . . . . 0.0 110.107 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -60.21 -48.17 82.86 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.541 0.736 . . . . 0.0 111.361 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -70.13 -43.07 71.72 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.423 0.689 . . . . 0.0 110.827 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.8 p -67.5 -34.28 76.82 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.562 -0.712 . . . . 0.0 111.087 -176.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -65.51 -7.03 12.39 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.1 0.864 . . . . 0.0 112.853 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -119.11 25.02 10.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.689 1.996 . . . . 0.0 109.432 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.495 HG21 ' HB2' ' A' ' 60' ' ' ALA . 84.2 m -129.51 153.07 48.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.516 1.927 . . . . 0.0 107.211 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.99 -45.66 92.66 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.514 -173.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.5 m 145.81 -175.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 1 C-N-CA 132.458 4.303 . . . . 0.0 108.39 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.4 pt-20 57.76 -49.21 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 130.981 3.712 . . . . 0.0 116.413 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.1 tt -152.96 153.67 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 120.798 1.636 . . . . 0.0 110.484 -173.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.495 ' HB2' HG21 ' A' ' 55' ' ' THR . . . -145.5 159.93 42.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.227 1.411 . . . . 0.0 110.232 171.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -113.56 99.07 7.47 Favored 'General case' 0 CA--C 1.52 -0.204 1 N-CA-C 100.065 -4.05 . . . . 0.0 100.065 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.496 HD21 HD21 ' A' ' 47' ' ' ASN . 11.6 tp -65.32 -66.36 0.56 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.033 -168.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -146.22 6.97 1.01 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.332 1.853 . . . . 0.0 110.263 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.27 -41.46 1.25 Allowed Glycine 0 CA--C 1.526 0.744 0 C-N-CA 126.361 1.934 . . . . 0.0 108.283 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.9 mt -66.61 139.68 57.9 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 169.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.3 m -98.98 142.81 29.99 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.44 142.15 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 m -111.42 147.63 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 169.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -152.79 157.59 41.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.088 0.47 . . . . 0.0 110.73 174.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.443 ' HE2' ' CE2' ' A' ' 98' ' ' PHE . 18.1 ptmt -144.49 171.37 14.45 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 169.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 m -140.44 137.91 34.3 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -145.12 140.56 28.1 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.225 0.61 . . . . 0.0 109.864 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.9 mp 50.36 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 127.358 2.263 . . . . 0.0 111.374 -169.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -142.61 16.27 1.99 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.471 1.908 . . . . 0.0 110.492 -176.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.1 145.99 44.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.846 2.058 . . . . 0.0 108.097 -169.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.24 138.08 53.02 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -134.13 139.15 45.71 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.61 1.164 . . . . 0.0 108.039 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -144.78 147.11 32.53 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.862 0.865 . . . . 0.0 110.059 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 70.9 t -137.82 131.08 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.0 139.46 48.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 -172.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -157.39 179.23 33.3 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-O 122.58 1.1 . . . . 0.0 113.074 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -62.4 156.04 23.66 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.266 1.826 . . . . 0.0 112.73 -171.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -71.81 33.35 0.06 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 127.575 2.35 . . . . 0.0 112.325 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -70.96 179.0 2.9 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.846 1.658 . . . . 0.0 111.285 -172.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -63.96 -12.94 42.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.085 1.754 . . . . 0.0 113.333 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -146.04 163.69 34.46 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.137 0.975 . . . . 0.0 110.172 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -7.15 7.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.833 2.453 . . . . 0.0 110.298 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -56.99 -36.34 70.25 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.79 1.636 . . . . 0.0 110.368 177.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -64.78 -34.9 79.43 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.1 0.56 . . . . 0.0 112.161 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -47.71 69.03 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -42.68 67.69 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.201 1.0 . . . . 0.0 110.052 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.71 65.35 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.006 1.322 . . . . 0.0 110.212 -177.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.97 -44.04 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.136 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 65.9 tp -61.2 -48.04 83.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 118.506 0.593 . . . . 0.0 110.341 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.56 -44.45 96.31 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 119.126 -0.464 . . . . 0.0 110.406 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.6 m -61.47 -45.9 92.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.275 0.489 . . . . 0.0 110.473 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.71 -49.3 68.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.478 0.581 . . . . 0.0 109.968 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.443 ' CE2' ' HE2' ' A' ' 70' ' ' LYS . 51.3 t80 -62.23 -42.22 99.12 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.899 0.381 . . . . 0.0 111.114 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -69.62 -37.27 76.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.533 -0.73 . . . . 0.0 110.647 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.5 m -62.97 -44.79 95.07 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.731 0.696 . . . . 0.0 111.221 175.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.8 mt -52.55 -51.46 59.58 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.6 m -58.44 -40.41 82.5 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.602 0.564 . . . . 0.0 111.097 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -66.74 -44.34 81.76 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.59 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -81.54 -30.64 33.05 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.782 1.174 . . . . 0.0 112.179 -177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -75.78 -44.66 40.38 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 119.154 0.888 . . . . 0.0 111.907 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 50.85 34.65 10.66 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.23 1.012 . . . . 0.0 111.973 -170.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -152.8 -176.92 5.95 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.784 1.633 . . . . 0.0 108.15 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -50.29 126.33 14.64 Favored 'General case' 0 CA--C 1.522 -0.112 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 35.1 m -76.04 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.399 1.48 . . . . 0.0 110.002 169.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.04 174.78 9.47 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.425 1.09 . . . . 0.0 110.805 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -52.08 -48.62 64.59 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.614 1.166 . . . . 0.0 112.304 -170.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 41.7 tpt85 -65.88 -35.92 81.98 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.907 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.0 -39.23 66.2 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.733 0.697 . . . . 0.0 111.107 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.03 -45.97 86.09 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 121.563 -0.711 . . . . 0.0 109.351 171.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 67.3 tp -61.34 -38.38 86.71 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.202 0.601 . . . . 0.0 111.793 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -65.29 -28.11 69.1 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.94 21.85 9.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.803 0.729 . . . . 0.0 112.531 -169.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.56 -50.77 2.22 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 125.564 1.546 . . . . 0.0 112.691 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -65.58 -39.24 91.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.076 0.853 . . . . 0.0 111.541 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.74 -43.17 99.35 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.11 -49.42 77.94 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.123 0.969 . . . . 0.0 110.605 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.58 -46.87 80.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.758 0.708 . . . . 0.0 109.708 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -65.75 -40.05 91.69 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.084 -0.484 . . . . 0.0 110.749 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.98 96.6 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.981 0.81 . . . . 0.0 110.125 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.77 -46.11 90.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 118.923 -0.56 . . . . 0.0 109.727 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -63.42 -25.47 68.29 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -84.85 -40.03 17.6 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.626 -0.671 . . . . 0.0 111.228 173.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.37 -42.54 87.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 119.136 0.88 . . . . 0.0 109.799 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -139.05 150.07 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.072 0 CA-C-N 119.245 0.929 . . . . 0.0 110.592 -174.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -149.97 132.96 16.17 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 125.059 1.344 . . . . 0.0 108.365 177.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.74 25.98 56.77 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.506 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 79.56 14.27 81.47 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.299 1.049 . . . . 0.0 113.255 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 20.2 t -126.73 141.43 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 119.257 1.529 . . . . 0.0 107.388 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -57.31 138.67 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.658 0.742 . . . . 0.0 109.852 172.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -125.3 -36.63 2.47 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.321 1.849 . . . . 0.0 108.21 -172.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -140.19 156.63 46.43 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 169.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.3 m -151.21 39.34 0.67 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.302 -0.874 . . . . 0.0 110.936 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -140.71 120.19 8.55 Favored Pre-proline 0 C--O 1.234 0.284 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 -29.69 17.91 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.108 1.872 . . . . 0.0 111.622 -169.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -69.41 -42.65 74.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -66.61 -43.63 84.29 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 41.4 t -55.85 -55.14 19.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.473 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.9 p -63.96 -41.21 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 119.051 0.841 . . . . 0.0 110.556 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -64.01 -43.42 95.68 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.003 0.82 . . . . 0.0 110.235 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.07 -48.06 83.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.378 0.536 . . . . 0.0 110.307 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.9 m -73.68 -26.57 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 119.247 0.93 . . . . 0.0 111.387 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.89 -34.9 74.16 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.739 0.699 . . . . 0.0 111.2 172.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.3 mp -75.83 -30.27 58.92 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.02 0.928 . . . . 0.0 111.947 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 118.535 0.607 . . . . 0.0 109.835 175.074 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 . . . . . 0 C--O 1.236 0.366 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -72.38 -28.12 62.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.071 0.548 . . . . 0.0 110.688 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.49 164.01 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.335 1.054 . . . . 0.0 108.268 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -133.1 -31.75 1.25 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 117.589 -1.196 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.86 165.82 31.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.833 1.197 . . . . 0.0 111.352 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.1 mt -138.08 135.63 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.8 mt -136.03 149.15 48.69 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 58.3 mt -138.75 125.27 24.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.9 mt -127.41 147.05 50.28 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 123.967 0.907 . . . . 0.0 108.964 -169.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -65.68 169.12 6.69 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -68.31 -15.13 63.45 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.626 1.17 . . . . 0.0 110.856 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -76.75 -7.2 54.93 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.062 -1.024 . . . . 0.0 112.06 171.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.18 51.16 29.14 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -169.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -130.32 136.35 49.04 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.578 1.151 . . . . 0.0 109.067 -173.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -60.59 124.28 19.9 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.211 0.605 . . . . 0.0 110.147 -174.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.1 mt -102.48 -41.19 6.38 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 158.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -145.25 151.13 37.9 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.746 0.818 . . . . 0.0 109.413 172.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.99 144.48 13.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.913 0.885 . . . . 0.0 108.69 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -149.7 149.76 31.08 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.869 0.868 . . . . 0.0 108.854 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -135.21 144.27 46.85 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 126.093 1.757 . . . . 0.0 106.786 -174.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -132.85 -8.94 3.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.785 -170.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.33 20.98 7.34 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.248 0.931 . . . . 0.0 112.87 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.2 t70 63.83 12.77 7.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.281 1.832 . . . . 0.0 113.602 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 p -62.84 -44.35 96.38 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.886 1.274 . . . . 0.0 110.555 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -141.0 83.69 13.77 Favored Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 106.409 -1.701 . . . . 0.0 106.409 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -92.5 0.03 3.95 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.667 2.244 . . . . 0.0 113.625 -170.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.0 m -136.24 139.39 42.7 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.195 0.998 . . . . 0.0 109.062 -169.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.7 t -43.83 -53.78 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 126.17 1.788 . . . . 0.0 112.845 -169.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -62.26 -44.21 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.572 0.624 . . . . 0.0 111.05 -173.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.38 -36.12 78.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -64.0 -50.35 68.87 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -56.7 -37.33 70.77 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.47 -0.769 . . . . 0.0 110.954 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.58 -44.82 77.25 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.866 0.466 . . . . 0.0 109.966 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.19 -36.95 83.46 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.4 -0.333 . . . . 0.0 110.645 175.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -65.18 -39.13 92.48 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.558 1.543 . . . . 0.0 111.231 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -64.5 -44.48 90.82 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.474 -0.766 . . . . 0.0 109.919 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.03 -48.15 76.51 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.083 -0.484 . . . . 0.0 110.571 174.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -55.11 -53.93 29.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 124.771 1.228 . . . . 0.0 108.714 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -64.82 -45.96 83.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.088 0.404 . . . . 0.0 110.588 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.44 -44.62 92.9 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 121.938 -0.476 . . . . 0.0 111.315 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtm -64.83 -50.6 66.05 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.4 p -70.84 -30.08 66.4 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.427 -0.796 . . . . 0.0 112.495 -169.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.65 -14.23 60.79 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.73 1.15 . . . . 0.0 113.36 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.43 9.09 21.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.229 1.012 . . . . 0.0 112.321 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.2 m -111.62 157.6 20.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.431 1.092 . . . . 0.0 109.013 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -80.19 30.45 0.27 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.616 1.566 . . . . 0.0 112.971 -170.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.4 m 65.07 -176.8 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.338 1.855 . . . . 0.0 113.635 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.311 10.4 pt-20 56.57 -45.45 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 131.581 3.952 . . . . 0.0 116.84 -176.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.0 tt -154.07 152.49 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 120.626 1.557 . . . . 0.0 110.084 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.08 177.58 9.76 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.81 1.644 . . . . 0.0 108.422 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.5 tt -141.87 122.16 13.94 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 170.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.54 140.77 29.04 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.286 1.034 . . . . 0.0 109.878 -169.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 51.18 28.1 3.88 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.943 1.297 . . . . 0.0 112.215 -176.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.4 -3.27 87.23 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 125.205 1.383 . . . . 0.0 113.816 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.7 mt -106.57 135.26 48.39 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 119.395 1.598 . . . . 0.0 109.226 -174.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 m -73.58 141.46 46.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 173.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.5 p -141.05 137.2 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.702 -0.624 . . . . 0.0 109.699 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.44 148.11 11.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 105.512 -2.032 . . . . 0.0 105.512 169.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 29.2 p90 -155.81 163.79 39.37 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.046 0.451 . . . . 0.0 111.377 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.86 175.89 11.23 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -140.67 142.14 34.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 m -146.16 141.38 27.43 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.832 0.853 . . . . 0.0 109.016 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.4 mp 54.43 -83.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.735 2.014 . . . . 0.0 110.829 -173.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -152.63 28.52 0.55 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.393 1.877 . . . . 0.0 109.482 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.406 HD23 ' CZ ' ' A' ' 77' ' ' PHE . 57.5 tp -132.85 147.37 52.3 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.967 1.707 . . . . 0.0 109.121 -169.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -125.34 141.27 52.17 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.406 ' CZ ' HD23 ' A' ' 75' ' ' LEU . 18.3 m-85 -134.49 143.54 47.53 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.865 1.266 . . . . 0.0 108.582 -170.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -147.2 145.61 29.55 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.185 0.994 . . . . 0.0 110.933 -169.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 94.0 t -135.81 129.49 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 169.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -122.04 138.07 53.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 -169.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.66 -175.33 24.86 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 122.287 0.937 . . . . 0.0 112.211 -177.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.3 m -59.8 159.01 9.47 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.362 1.465 . . . . 0.0 112.28 -173.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.81 25.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 127.483 2.313 . . . . 0.0 112.599 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -73.07 -179.67 3.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.954 1.302 . . . . 0.0 112.495 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -113.61 29.98 7.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.513 1.525 . . . . 0.0 113.066 -169.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 88' ' ' LEU . 2.7 p30 -128.41 -39.51 1.67 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 116.563 -1.684 . . . . 0.0 113.592 169.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.251 8.6 pm0 49.79 -16.73 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 128.36 2.664 . . . . 0.0 117.441 -173.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' ' 86' ' ' ASN . 35.5 mt -58.98 -34.23 71.59 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 127.213 2.205 . . . . 0.0 110.893 177.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -65.57 -34.09 77.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.257 0.935 . . . . 0.0 111.738 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.0 mt -68.46 -46.88 68.6 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -53.18 -42.95 66.72 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.17 0.988 . . . . 0.0 109.958 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.33 -50.23 68.59 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.379 1.472 . . . . 0.0 110.265 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.67 -42.92 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 118.651 0.659 . . . . 0.0 110.168 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.76 -49.49 76.2 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.753 0.706 . . . . 0.0 110.488 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.06 -43.69 98.5 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.098 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.7 m -61.07 -46.1 92.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.529 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 tp -65.56 -46.4 79.64 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 119.756 1.162 . . . . 0.0 110.982 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -64.06 -42.82 96.88 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.031 0.443 . . . . 0.0 110.771 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -68.57 -38.81 81.04 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.536 -0.728 . . . . 0.0 110.959 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.1 m -60.9 -48.96 79.43 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.261 0.624 . . . . 0.0 110.666 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.7 mt -50.92 -49.29 59.93 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.844 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -68.23 -53.78 22.3 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.668 1.122 . . . . 0.0 111.032 178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 13.4 ptt? -70.63 -30.18 66.75 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.613 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.409 HD12 HG12 ' A' ' 109' ' ' VAL . 17.9 mt -75.99 -43.06 46.23 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.59 0.632 . . . . 0.0 112.171 174.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 51.54 36.22 16.49 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.505 1.122 . . . . 0.0 110.793 -169.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -150.05 170.9 17.8 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 127.074 2.149 . . . . 0.0 107.045 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -57.55 132.68 53.92 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.262 0.625 . . . . 0.0 109.799 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.409 HG12 HD12 ' A' ' 105' ' ' LEU . 3.9 m -89.37 42.08 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 124.579 1.152 . . . . 0.0 111.115 -169.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.6 178.02 1.09 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.619 1.168 . . . . 0.0 112.113 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -46.41 -54.63 8.75 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.455 1.102 . . . . 0.0 111.778 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -63.27 -42.15 99.11 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.715 0.234 . . . . 0.0 111.614 -176.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.312 0.0 OUTLIER -79.55 -31.98 42.08 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.409 -1.432 . . . . 0.0 111.254 175.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.99 -41.72 92.68 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.815 0.734 . . . . 0.0 111.269 170.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -74.48 -10.62 59.74 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.592 -0.693 . . . . 0.0 112.607 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.96 27.32 4.9 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.472 1.109 . . . . 0.0 112.878 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.1 mmt -43.17 -43.9 4.85 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.741 1.216 . . . . 0.0 112.723 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -63.81 -42.22 97.72 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.203 0.91 . . . . 0.0 111.211 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.3 96.4 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 tp -55.61 -51.9 65.61 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.844 1.257 . . . . 0.0 110.219 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -57.43 -47.32 82.1 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.013 0.525 . . . . 0.0 109.613 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 69.5 mt -65.0 -39.22 93.13 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.091 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.97 -44.33 89.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.843 0.747 . . . . 0.0 110.563 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 39.9 t -56.28 -48.24 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.53 6.8 0.98 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.52 1.528 . . . . 0.0 113.57 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -126.16 -23.28 3.91 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.743 1.617 . . . . 0.0 110.682 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 48.0 mt -84.35 -37.78 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.9 159.35 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 119.797 1.181 . . . . 0.0 111.239 -172.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -159.99 138.03 10.08 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.482 1.513 . . . . 0.0 108.366 169.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.59 26.53 57.3 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-O 119.434 -0.648 . . . . 0.0 114.464 171.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.49 13.77 75.28 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-N 118.215 1.007 . . . . 0.0 113.13 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 t -128.84 141.46 46.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 29.8 pt -64.16 158.95 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.734 0.778 . . . . 0.0 110.071 170.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.7 mt -116.98 -39.9 3.19 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.714 1.606 . . . . 0.0 108.769 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -155.68 160.97 40.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.624 1.169 . . . . 0.0 108.419 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.5 p -138.03 37.88 2.35 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.658 1.583 . . . . 0.0 109.799 -173.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -136.1 120.13 12.75 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.48 -34.11 6.14 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.355 2.037 . . . . 0.0 112.149 -170.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -67.23 -45.66 76.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -65.73 -38.73 89.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.668 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 5.0 t -56.48 -53.58 38.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 119.141 0.882 . . . . 0.0 109.895 173.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 70.7 t -64.57 -36.49 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.725 1.148 . . . . 0.0 110.372 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.32 -50.81 72.29 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.989 0.813 . . . . 0.0 110.239 174.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.1 mtt-85 -59.54 -43.46 93.51 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 111.102 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 51.1 t -59.0 -43.6 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.624 1.102 . . . . 0.0 110.048 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.2 -32.66 70.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.024 0.53 . . . . 0.0 111.691 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.9 tp -73.49 -28.65 62.04 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.268 1.827 . . . . 0.0 112.268 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 123.735 0.814 . . . . 0.0 109.891 175.643 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 . . . . . 0 C--O 1.235 0.293 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 m -71.94 -38.75 69.76 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 168.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -141.78 135.26 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 126.452 1.901 . . . . 0.0 106.555 175.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -92.55 -36.66 12.91 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 0.0 110.736 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.67 167.29 28.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.996 0.816 . . . . 0.0 111.947 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.3 mt -135.33 135.4 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 104.893 -2.262 . . . . 0.0 104.893 171.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.6 mt -133.02 148.68 52.24 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.469 ' CG2' HD11 ' A' ' 75' ' ' LEU . 57.5 mt -136.78 113.18 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 102.763 -3.051 . . . . 0.0 102.763 169.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.2 mt -122.06 146.95 46.7 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.401 0.68 . . . . 0.0 109.678 -169.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.41 169.81 5.53 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 168.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -14.87 59.75 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.38 1.072 . . . . 0.0 112.413 173.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -75.22 -9.33 58.45 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.193 0.997 . . . . 0.0 112.139 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.83 51.47 15.09 Favored Glycine 0 C--N 1.339 0.737 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -140.06 133.45 29.97 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.259 1.023 . . . . 0.0 108.684 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 124.84 22.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.279 0.491 . . . . 0.0 111.609 -170.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.8 mt -82.45 -37.42 25.44 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 153.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -145.55 151.97 38.98 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.055 1.342 . . . . 0.0 108.853 170.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -154.7 147.57 24.49 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -138.34 135.16 35.1 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 171.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -123.54 129.77 51.68 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -103.66 -24.51 13.36 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -55.07 158.46 2.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.086 2.554 . . . . 0.0 112.575 169.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -119.52 1.39 11.16 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.795 1.638 . . . . 0.0 111.867 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 m -75.81 -35.25 60.08 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.792 1.237 . . . . 0.0 110.084 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -130.15 67.91 80.37 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 125.287 1.435 . . . . 0.0 108.784 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -89.14 -1.38 6.21 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.814 2.343 . . . . 0.0 113.713 -173.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 m -137.63 148.92 46.2 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.894 0.878 . . . . 0.0 110.313 -169.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.7 t -45.54 -53.61 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 126.327 1.851 . . . . 0.0 112.733 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -54.61 -47.94 72.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 118.593 0.633 . . . . 0.0 111.064 -175.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -75.47 -34.16 60.88 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 -176.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -63.07 -46.81 85.7 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.815 0.846 . . . . 0.0 110.625 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -63.86 -34.24 77.49 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.281 0.946 . . . . 0.0 111.068 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -47.22 78.33 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.903 -0.498 . . . . 0.0 109.897 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -61.6 -40.02 93.3 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.95 0.9 . . . . 0.0 110.805 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -57.41 -49.9 74.74 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.654 1.581 . . . . 0.0 111.168 172.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -62.4 -40.96 98.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.808 1.186 . . . . 0.0 110.53 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -48.46 77.96 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.028 0.531 . . . . 0.0 110.641 173.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.6 mt -60.85 -48.05 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.08 0 C-N-CA 123.712 0.805 . . . . 0.0 109.481 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -58.84 -45.91 88.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.484 0.714 . . . . 0.0 110.158 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -63.02 -42.13 99.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.857 0.463 . . . . 0.0 112.066 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -68.86 -50.46 49.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.885 0.474 . . . . 0.0 110.471 -177.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.5 p -61.55 -35.15 76.96 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 123.733 0.813 . . . . 0.0 112.89 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.45 0.3 3.11 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -119.93 33.48 5.6 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.307 1.443 . . . . 0.0 109.761 -171.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.4 p -135.97 -174.4 3.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.069 0.948 . . . . 0.0 111.116 -169.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -78.63 6.02 9.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.77 1.228 . . . . 0.0 111.814 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m 68.79 31.25 4.51 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.264 1.826 . . . . 0.0 115.347 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.46 -16.69 4.31 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.917 0.487 . . . . 0.0 111.154 169.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.1 tt -164.74 156.28 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.361 1.064 . . . . 0.0 109.127 -171.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.82 171.81 14.62 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.351 1.861 . . . . 0.0 108.965 170.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -131.94 116.76 17.56 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.5 mt -78.15 -128.49 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.18 1.392 . . . . 0.0 108.535 -175.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -82.16 2.47 31.38 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.127 -0.983 . . . . 0.0 111.698 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.16 -33.29 0.51 Allowed Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.951 1.739 . . . . 0.0 110.474 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.0 mt -67.06 155.42 38.73 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.836 0.854 . . . . 0.0 109.423 173.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 55.8 m -112.45 145.2 40.6 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -138.56 130.32 37.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.0 m -97.45 146.04 8.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -156.49 167.14 31.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.124 0.42 . . . . 0.0 111.021 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -155.19 178.59 10.03 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.616 1.166 . . . . 0.0 108.103 169.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.1 p -142.42 148.59 38.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.91 0.484 . . . . 0.0 109.847 170.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.1 m -146.74 143.21 28.53 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.833 1.253 . . . . 0.0 108.936 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.2 mp 52.5 -87.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.507 1.923 . . . . 0.0 111.141 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -144.9 16.86 1.59 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.589 1.956 . . . . 0.0 109.76 -178.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.469 HD11 ' CG2' ' A' ' 18' ' ' ILE . 23.4 tp -120.22 144.07 47.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.971 2.108 . . . . 0.0 108.397 -169.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -122.55 146.02 47.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -135.51 137.47 42.14 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 -171.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -146.66 150.64 35.82 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.883 0.873 . . . . 0.0 110.529 -171.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 83.9 t -140.39 129.75 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.53 144.13 27.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -162.2 -175.76 33.57 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 121.814 0.674 . . . . 0.0 112.203 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 155.31 23.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.192 1.397 . . . . 0.0 111.343 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -56.23 -46.61 79.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.189 0.996 . . . . 0.0 110.677 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 15.0 t80 51.07 -169.83 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.204 2.202 . . . . 0.0 112.935 173.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -82.72 -18.29 41.34 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.356 -0.84 . . . . 0.0 111.405 175.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -157.49 176.94 12.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 125.478 1.511 . . . . 0.0 109.662 -175.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.79 4.18 8.13 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.119 2.167 . . . . 0.0 110.512 -174.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.8 mt -69.63 -32.4 71.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.558 1.143 . . . . 0.0 111.093 -173.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -34.16 77.53 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.248 0.931 . . . . 0.0 111.149 173.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.1 mt -66.76 -48.3 69.52 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.8 mmt -54.34 -42.85 70.71 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.029 0.531 . . . . 0.0 110.335 174.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.6 84.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.707 0.803 . . . . 0.0 110.502 -177.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.72 -43.67 96.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.062 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.9 tp -61.2 -49.15 78.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.131 0.878 . . . . 0.0 110.417 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -63.48 -42.91 98.55 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.306 -178.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.56 -51.89 67.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.66 -47.52 83.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.439 0.563 . . . . 0.0 110.26 -176.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -65.4 -40.16 93.06 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.976 0.353 . . . . 0.0 111.497 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -71.72 -32.87 68.23 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.266 -0.896 . . . . 0.0 111.191 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -61.06 -49.89 75.5 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.685 0.794 . . . . 0.0 110.268 174.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.8 mt -52.44 -51.24 60.23 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -59.05 -19.68 46.32 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -84.78 -55.08 4.28 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 120.637 1.562 . . . . 0.0 110.44 171.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 23.0 ptt? -78.11 -7.44 57.0 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -171.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 30.0 tp -144.68 59.35 1.32 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 127.291 2.236 . . . . 0.0 106.124 -171.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -52.55 -17.69 1.37 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.092 . . . . 0.0 114.929 -170.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -66.14 -166.15 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.45 1.023 . . . . 0.0 111.217 170.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -76.8 9.13 3.05 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.257 24.0 m 42.76 41.69 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 125.84 1.656 . . . . 0.0 112.914 -175.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -75.52 176.16 7.84 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.262 1.025 . . . . 0.0 111.184 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -49.85 -49.59 48.62 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.133 0.973 . . . . 0.0 112.972 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -62.9 -40.37 97.36 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.037 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.19 94.24 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.509 0.595 . . . . 0.0 110.305 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -59.78 -49.76 76.45 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.874 0.87 . . . . 0.0 110.107 175.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.33 -40.43 74.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.693 1.197 . . . . 0.0 110.98 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.87 -14.12 62.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.822 0.849 . . . . 0.0 113.086 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -133.72 22.38 3.93 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.919 0.887 . . . . 0.0 112.284 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.3 mmt -45.6 -45.37 13.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.301 1.44 . . . . 0.0 111.872 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.85 -40.29 94.92 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.433 1.015 . . . . 0.0 111.7 -177.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.0 -42.23 94.81 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 177.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 tp -57.09 -51.26 69.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.235 1.014 . . . . 0.0 110.493 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -55.5 -46.86 76.92 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.337 0.655 . . . . 0.0 109.286 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.57 -41.83 96.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.893 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -59.82 -45.35 92.66 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.613 1.097 . . . . 0.0 110.496 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.26 -42.71 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.616 0.644 . . . . 0.0 109.831 175.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -66.17 -26.34 67.37 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.376 0.67 . . . . 0.0 112.804 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -79.47 -34.67 41.23 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.163 0.892 . . . . 0.0 110.892 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 81.4 mt -79.56 -40.36 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.015 -174.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.6 t -133.9 145.56 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.302 0.955 . . . . 0.0 110.166 -169.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -146.16 131.92 19.0 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.415 1.486 . . . . 0.0 107.456 169.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.56 25.1 54.73 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 123.555 0.598 . . . . 0.0 113.705 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.09 22.92 78.65 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.241 1.02 . . . . 0.0 113.387 -177.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 58.5 t -128.73 140.43 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 176.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.0 pt -69.08 159.36 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-O 121.377 0.608 . . . . 0.0 110.395 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.8 mt -121.71 -34.2 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.136 1.375 . . . . 0.0 109.512 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -156.09 158.18 37.29 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.743 1.217 . . . . 0.0 108.477 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.5 m -135.5 -3.81 2.35 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.664 1.585 . . . . 0.0 111.627 177.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -77.26 116.34 56.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 119.316 0.962 . . . . 0.0 108.743 169.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.65 -33.91 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.563 2.176 . . . . 0.0 112.109 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -68.04 -44.41 76.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -68.36 -34.57 76.31 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.171 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.76 -51.6 68.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 119.182 0.901 . . . . 0.0 109.587 170.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 63.8 t -63.19 -36.92 77.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.768 1.167 . . . . 0.0 110.613 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -46.84 87.95 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.197 0.908 . . . . 0.0 110.154 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 48.0 mtp180 -60.01 -44.51 94.54 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.089 175.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 78.1 t -58.48 -46.33 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 119.697 1.135 . . . . 0.0 109.707 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.53 -33.11 74.4 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.358 0.663 . . . . 0.0 111.663 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 64.7 tp -71.35 -31.42 67.32 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.93 1.692 . . . . 0.0 111.644 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.947 175.651 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 . . . . . 0 C--O 1.236 0.373 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -68.33 -31.08 70.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.428 0.558 . . . . 0.0 109.622 176.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.49 125.97 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 169.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.443 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 65.1 mttm -81.05 -32.18 34.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 117.986 -1.007 . . . . 0.0 109.091 171.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.56 168.15 26.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.961 0.8 . . . . 0.0 111.735 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.9 mt -136.65 138.02 46.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 104.303 -2.48 . . . . 0.0 104.303 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mt -137.0 151.0 48.47 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -138.19 120.2 18.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 103.343 -2.836 . . . . 0.0 103.343 169.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.7 mt -126.05 147.0 49.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.45 169.41 6.01 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.181 0.515 . . . . 0.0 110.845 171.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -9.66 0.65 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 116.572 2.064 . . . . 0.0 116.572 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -119.95 9.37 11.24 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.145 1.378 . . . . 0.0 110.586 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.24 19.6 54.83 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.635 1.112 . . . . 0.0 112.469 173.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.4 133.28 39.94 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.358 1.579 . . . . 0.0 109.671 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -55.89 126.02 23.9 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.111 0.965 . . . . 0.0 108.98 176.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.3 mt -116.81 -45.73 2.77 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 165.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -143.83 152.69 41.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.54 148.63 19.76 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -141.7 136.12 30.52 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 171.075 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -125.73 146.82 49.59 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -130.61 -34.11 1.58 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.914 0.886 . . . . 0.0 111.329 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -78.93 159.59 27.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 172.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -78.53 7.79 6.19 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.935 1.694 . . . . 0.0 111.95 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 p -64.69 -45.99 84.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.244 1.418 . . . . 0.0 111.42 -177.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.9 70.88 29.5 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.338 1.055 . . . . 0.0 109.213 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -86.26 -1.46 8.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.573 2.182 . . . . 0.0 113.538 -173.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.8 m -134.52 138.35 44.59 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.126 0.97 . . . . 0.0 109.684 -169.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.0 t -46.31 -49.05 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.299 1.839 . . . . 0.0 112.937 -169.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -57.15 -46.57 82.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.383 0.538 . . . . 0.0 110.816 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.27 -32.07 60.93 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.286 -0.259 . . . . 0.0 110.349 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -62.72 -51.25 67.92 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 122.941 0.496 . . . . 0.0 110.203 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -59.64 -34.29 72.61 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.566 -0.708 . . . . 0.0 110.764 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.1 -47.28 74.72 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.745 0.418 . . . . 0.0 109.954 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -61.14 -36.63 80.29 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.829 0.451 . . . . 0.0 110.916 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -65.77 -40.94 92.51 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.17 1.388 . . . . 0.0 111.276 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -66.68 -39.24 88.04 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.245 0.93 . . . . 0.0 110.109 173.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -48.74 76.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.992 0.517 . . . . 0.0 110.622 171.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -56.74 -54.6 27.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.109 0 C-N-CA 124.475 1.11 . . . . 0.0 108.513 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -58.72 -48.78 79.97 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.328 0.651 . . . . 0.0 110.208 -176.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -60.74 -45.13 95.48 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.319 0.648 . . . . 0.0 111.894 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -70.02 -48.9 56.14 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 34.5 p -67.5 -28.18 67.62 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.591 -0.693 . . . . 0.0 112.088 -174.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.34 -18.76 60.19 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 118.796 0.725 . . . . 0.0 111.896 174.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtt-85 -113.76 19.22 16.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.751 1.62 . . . . 0.0 110.482 -172.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.3 m -131.49 154.44 48.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.759 1.224 . . . . 0.0 109.07 -169.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.79 88.73 4.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.31 1.044 . . . . 0.0 109.306 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.9 m -46.66 136.95 7.35 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 126.171 1.788 . . . . 0.0 115.808 -169.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.74 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 1 C-N-CA 133.031 4.533 . . . . 0.0 107.75 172.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 tt -153.43 158.92 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.386 1.474 . . . . 0.0 108.569 178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.34 165.04 34.28 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.72 2.008 . . . . 0.0 108.778 173.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -131.21 104.32 6.99 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 102.16 -3.274 . . . . 0.0 102.16 170.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -76.65 -64.87 1.02 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -168.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -141.77 6.55 1.83 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.837 1.655 . . . . 0.0 110.617 -173.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.4 -39.13 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 126.442 1.972 . . . . 0.0 109.169 -173.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.6 mt -72.98 132.98 44.11 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.406 0.682 . . . . 0.0 109.869 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.2 m -83.41 142.91 30.65 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.8 t -135.67 138.13 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.15 133.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.6 p90 -156.73 164.31 38.27 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -169.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -152.33 177.47 10.54 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.698 1.199 . . . . 0.0 108.989 172.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.0 p -143.66 147.87 34.94 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.255 0.622 . . . . 0.0 109.38 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.0 m -146.97 137.99 23.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.483 1.113 . . . . 0.0 108.894 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 mp 53.16 -84.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 127.483 2.313 . . . . 0.0 112.551 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -143.92 23.29 1.73 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.795 1.638 . . . . 0.0 109.552 -176.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 tp -132.04 145.35 51.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.63 1.572 . . . . 0.0 109.152 -169.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -125.85 146.11 49.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.41 138.45 46.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -144.3 148.81 35.29 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 123.568 0.747 . . . . 0.0 110.109 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -134.44 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 104.432 -2.433 . . . . 0.0 104.432 170.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.27 134.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -173.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.443 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -156.98 177.08 34.05 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-O 122.398 0.999 . . . . 0.0 113.172 -177.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.3 m -63.68 164.36 9.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 112.867 -1.666 . . . . 0.0 109.5 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -128.09 28.23 5.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.943 0.897 . . . . 0.0 110.597 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -60.37 -40.91 92.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.738 0.815 . . . . 0.0 112.968 -169.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -156.19 -23.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -145.9 165.77 27.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.339 0.972 . . . . 0.0 111.634 -171.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.8 -7.55 5.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.327 2.651 . . . . 0.0 110.326 177.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.66 -33.27 72.56 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.664 1.186 . . . . 0.0 110.775 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -64.09 -34.28 77.69 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.135 0.88 . . . . 0.0 111.819 174.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.22 -42.02 63.11 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.9 mmt -58.2 -40.75 82.37 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.521 171.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.06 -50.13 71.83 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.827 0.851 . . . . 0.0 109.815 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.42 -45.07 99.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 118.918 -0.563 . . . . 0.0 109.94 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 39.3 tp -60.47 -48.89 79.8 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.475 0.579 . . . . 0.0 110.304 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.46 -44.87 93.22 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.381 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 87.7 m -62.78 -43.85 97.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.523 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.9 tp -64.68 -51.73 60.93 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.785 0.72 . . . . 0.0 110.158 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -61.31 -42.04 97.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.396 0.278 . . . . 0.0 110.701 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.98 -38.56 66.62 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.593 -0.692 . . . . 0.0 111.483 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 m -61.51 -43.89 98.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.133 0.879 . . . . 0.0 110.379 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 mt -57.71 -45.76 85.31 Favored 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.2 m -61.4 -26.4 67.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.829 -0.605 . . . . 0.0 112.235 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -75.34 -53.13 9.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.819 1.19 . . . . 0.0 110.365 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 3.0 ptp -69.85 -39.42 76.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.012 0.824 . . . . 0.0 112.076 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.27 -37.82 60.76 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.532 0.606 . . . . 0.0 110.172 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 48.11 33.53 3.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.47 1.508 . . . . 0.0 113.028 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -153.31 -172.21 4.16 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.92 2.088 . . . . 0.0 107.421 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -50.0 122.9 7.26 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.804 0.842 . . . . 0.0 109.322 173.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 m -78.03 40.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 C-N-CA 125.029 1.332 . . . . 0.0 110.251 170.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.19 172.56 12.64 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.673 1.189 . . . . 0.0 112.231 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -43.77 -60.23 1.89 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.981 2.112 . . . . 0.0 112.874 -177.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -63.11 -46.11 88.87 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.726 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.71 82.08 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.943 0.792 . . . . 0.0 111.405 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.3 mp -74.14 -36.21 64.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.978 175.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.3 tp -58.63 -37.19 75.39 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.162 0.892 . . . . 0.0 110.956 171.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -73.9 -15.42 61.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 175.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -124.58 25.87 7.41 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.581 1.082 . . . . 0.0 111.454 -173.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.32 -48.63 18.25 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.908 1.283 . . . . 0.0 112.007 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.98 -39.51 94.3 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.721 0.691 . . . . 0.0 111.343 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.97 96.74 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.03 -50.6 72.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.609 1.163 . . . . 0.0 110.357 174.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -55.41 -48.07 74.93 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.028 0.531 . . . . 0.0 109.816 178.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.9 mt -65.56 -37.8 87.73 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.17 0.588 . . . . 0.0 111.397 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.37 -47.08 83.58 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 118.872 0.76 . . . . 0.0 109.906 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.95 -46.21 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.3 -2.92 4.92 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.125 1.37 . . . . 0.0 113.804 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -117.16 -12.94 10.52 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.749 1.22 . . . . 0.0 112.005 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 59.8 mt -87.9 -40.39 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.278 0.945 . . . . 0.0 108.503 173.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.32 156.24 21.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 124.936 1.294 . . . . 0.0 109.901 -172.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -149.8 136.44 19.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.252 1.421 . . . . 0.0 107.217 169.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.97 29.07 50.62 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 119.242 -0.755 . . . . 0.0 113.182 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.08 10.67 85.28 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 118.299 1.049 . . . . 0.0 113.835 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.12 133.33 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-N 119.079 1.439 . . . . 0.0 107.265 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.1 pt -57.77 145.15 9.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.085 0.554 . . . . 0.0 110.393 173.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -133.81 -14.22 2.46 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.202 1.001 . . . . 0.0 112.018 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -149.86 159.88 44.02 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.9 m -150.69 41.81 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.874 1.27 . . . . 0.0 109.464 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -139.94 119.86 9.05 Favored Pre-proline 0 C--O 1.235 0.325 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 173.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -30.82 13.18 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.056 1.837 . . . . 0.0 112.114 -169.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.18 -41.47 85.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -68.27 -42.1 80.08 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.473 0.579 . . . . 0.0 109.685 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 28.6 t -55.96 -55.8 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 118.845 -0.597 . . . . 0.0 109.471 176.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 5.2 p -65.26 -33.16 61.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 119.604 1.093 . . . . 0.0 110.798 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -60.59 -44.32 96.38 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.177 0.899 . . . . 0.0 110.566 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -63.57 -42.65 98.3 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.469 -0.769 . . . . 0.0 110.935 175.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.1 t -58.18 -42.2 82.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.968 0.804 . . . . 0.0 109.745 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.11 77.46 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.578 0.751 . . . . 0.0 111.902 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.94 -39.22 79.68 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.479 0.711 . . . . 0.0 111.386 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 54.9 mtp180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.427 -176.487 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 120.84 0.352 . . . . 0.0 111.904 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.6 m -58.1 -35.56 71.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.699 1.599 . . . . 0.0 110.649 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -155.24 151.34 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -117.27 -30.42 5.6 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 117.585 -1.198 . . . . 0.0 111.747 -173.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.58 166.6 26.71 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 119.837 1.199 . . . . 0.0 111.656 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.1 mt -137.03 136.45 47.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -133.3 148.22 51.91 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.7 mt -139.06 118.18 13.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 169.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.4 mt -122.68 146.71 47.23 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -173.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 168.81 8.16 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.219 0.533 . . . . 0.0 110.31 169.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -12.23 1.54 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -115.97 3.64 13.69 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.94 1.296 . . . . 0.0 110.919 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.99 5.23 55.06 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.073 1.32 . . . . 0.0 113.084 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -69.8 133.76 47.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.426 1.613 . . . . 0.0 109.89 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -61.15 123.87 18.94 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 118.504 0.593 . . . . 0.0 109.653 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -100.08 -40.86 7.4 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 162.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -150.09 152.93 35.55 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.458 172.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.17 146.84 19.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 168.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.454 ' HE2' ' H ' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -147.46 146.78 29.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 170.437 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.454 ' H ' ' HE2' ' A' ' 29' ' ' LYS . 79.7 m-85 -133.6 151.72 51.75 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.969 1.708 . . . . 0.0 106.662 -177.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -135.92 1.4 2.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.869 0.868 . . . . 0.0 111.887 -175.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -133.68 158.31 43.59 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.737 0.815 . . . . 0.0 109.447 -176.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.52 5.19 3.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.358 2.263 . . . . 0.0 112.609 -173.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 p -62.21 -50.09 73.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.645 1.178 . . . . 0.0 110.532 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -142.68 64.71 15.84 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 124.193 0.997 . . . . 0.0 109.992 -174.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -82.18 -2.02 11.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.778 2.319 . . . . 0.0 113.598 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.5 m -138.01 143.68 40.71 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.914 0.886 . . . . 0.0 110.287 -169.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.8 t -45.62 -51.3 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 126.491 1.916 . . . . 0.0 113.127 -169.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -58.67 -46.64 86.75 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.799 0.727 . . . . 0.0 110.893 -176.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -70.37 -34.48 72.65 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.639 0.376 . . . . 0.0 110.165 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -63.2 -52.04 63.87 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.231 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -60.18 -35.35 75.17 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.894 0.77 . . . . 0.0 111.348 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.15 -49.92 70.24 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -63.4 -39.47 94.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.589 0.355 . . . . 0.0 111.023 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.07 -40.55 98.03 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.927 1.691 . . . . 0.0 111.564 178.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -69.32 -40.96 77.32 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.648 -0.657 . . . . 0.0 110.001 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.12 -48.78 73.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.979 0.512 . . . . 0.0 110.557 171.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.521 HD13 HD22 ' A' ' 62' ' ' LEU . 2.9 mm -54.86 -59.92 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 C-N-CA 125.133 1.373 . . . . 0.0 108.092 178.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -57.65 -45.33 85.62 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.629 0.772 . . . . 0.0 111.323 -172.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -57.84 -52.92 63.5 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 122.687 0.395 . . . . 0.0 110.507 176.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -63.9 -45.83 87.57 Favored 'General case' 0 C--O 1.23 0.062 0 CA-C-O 119.431 -0.318 . . . . 0.0 110.191 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.2 p -68.27 -32.06 71.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 119.205 0.911 . . . . 0.0 111.996 -172.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -73.51 0.55 12.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.442 1.019 . . . . 0.0 112.981 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -136.92 35.42 2.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.948 1.299 . . . . 0.0 110.451 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.3 m -135.88 156.98 47.95 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.387 1.875 . . . . 0.0 108.14 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -80.17 86.09 5.64 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.327 1.051 . . . . 0.0 109.055 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.7 m -50.57 144.27 8.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -169.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 145.45 -42.84 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 1 C-N-CA 133.553 4.741 . . . . 0.0 105.823 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -157.35 160.15 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.748 1.219 . . . . 0.0 108.973 -178.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.23 174.57 15.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.894 1.678 . . . . 0.0 110.207 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -136.7 116.89 13.46 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 176.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.521 HD22 HD13 ' A' ' 48' ' ' ILE . 10.2 mp -127.63 117.79 22.66 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.236 1.414 . . . . 0.0 107.296 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 50.68 31.49 5.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.121 1.368 . . . . 0.0 112.765 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.03 -16.03 61.59 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.859 1.218 . . . . 0.0 113.471 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.0 mt -91.21 134.15 34.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.456 1.628 . . . . 0.0 109.258 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 61.3 m -76.18 141.82 41.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 172.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.2 t -133.67 137.87 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -128.65 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 174.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -158.19 164.72 36.26 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.292 0.496 . . . . 0.0 112.218 -169.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -148.42 171.54 15.88 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.756 1.222 . . . . 0.0 108.352 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 p -145.47 143.91 30.29 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 169.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 17.1 m -147.24 142.89 27.71 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 109.665 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.4 mt 63.87 -81.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.382 1.873 . . . . 0.0 111.68 169.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -151.61 27.26 0.65 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.354 1.861 . . . . 0.0 109.151 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.2 tp -138.98 147.35 42.07 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.967 1.707 . . . . 0.0 110.062 -168.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -129.53 144.99 51.5 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.364 1.466 . . . . 0.0 107.454 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -132.85 137.19 46.63 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.433 1.493 . . . . 0.0 107.236 -172.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -146.13 151.19 37.27 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.728 0.695 . . . . 0.0 110.479 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.0 t -138.22 141.58 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 105.018 -2.215 . . . . 0.0 105.018 169.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.22 141.12 44.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 -172.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.89 -178.91 36.2 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 121.739 0.633 . . . . 0.0 113.062 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -62.57 164.8 7.04 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 113.973 -1.114 . . . . 0.0 110.205 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.1 m -124.68 43.96 2.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.866 0.866 . . . . 0.0 111.021 -169.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -71.91 -166.64 0.23 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 122.863 0.465 . . . . 0.0 110.21 169.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -58.41 -3.6 0.3 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 117.049 2.24 . . . . 0.0 117.049 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.69 167.69 25.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 120.27 1.396 . . . . 0.0 111.211 176.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.82 -0.91 2.78 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.486 2.715 . . . . 0.0 110.295 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.8 mt -63.65 -32.55 74.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.792 1.237 . . . . 0.0 109.937 -175.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -34.53 78.51 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.896 0.771 . . . . 0.0 111.355 175.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 mt -70.57 -45.19 65.87 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.5 mtp -58.94 -37.43 76.71 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.832 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.13 74.02 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.776 0.83 . . . . 0.0 110.364 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.6 t -59.05 -46.34 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.7 tp -58.05 -49.96 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.993 0.517 . . . . 0.0 110.366 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -63.6 -43.55 96.6 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 119.116 -0.469 . . . . 0.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.3 m -64.21 -42.18 96.73 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.491 0.587 . . . . 0.0 110.709 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.3 tp -67.93 -46.62 71.0 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.638 0.654 . . . . 0.0 110.241 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -62.34 -42.95 99.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.679 0.392 . . . . 0.0 111.046 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -76.58 -37.93 55.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.364 -0.835 . . . . 0.0 111.174 -176.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.7 p -63.13 -39.67 95.35 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.641 1.11 . . . . 0.0 110.442 175.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 11.6 mt -54.35 -52.64 60.96 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 m -56.21 -33.42 65.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.885 0.474 . . . . 0.0 111.928 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -69.25 -59.24 3.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.086 173.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.6 ptt? -69.6 -31.52 69.71 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.061 1.301 . . . . 0.0 113.472 -169.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.84 -35.42 74.73 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.824 0.738 . . . . 0.0 111.794 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? 49.08 33.29 4.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.424 1.09 . . . . 0.0 112.039 -171.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -155.21 175.66 13.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.076 2.151 . . . . 0.0 106.585 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -62.48 136.31 57.84 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -76.16 51.97 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.204 1.802 . . . . 0.0 111.02 -174.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.08 169.99 17.36 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.508 1.123 . . . . 0.0 111.745 -177.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -47.47 -55.42 9.09 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.366 1.866 . . . . 0.0 112.799 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -66.36 -38.27 87.19 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.221 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.76 -35.84 82.38 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.337 0.971 . . . . 0.0 110.864 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.99 -42.88 80.12 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 118.94 0.791 . . . . 0.0 110.685 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 58.1 tp -58.26 -37.4 74.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.667 0.667 . . . . 0.0 111.211 176.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -69.61 -18.45 63.61 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.104 0.962 . . . . 0.0 113.011 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -126.23 24.67 6.8 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.225 1.01 . . . . 0.0 111.525 -171.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -44.35 -49.34 9.6 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.475 1.51 . . . . 0.0 112.424 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.63 -42.48 98.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.205 0.911 . . . . 0.0 110.952 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.95 -43.88 98.24 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.14 -50.46 73.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.391 1.076 . . . . 0.0 110.837 175.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -55.06 -48.78 73.0 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.383 0.673 . . . . 0.0 109.871 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 97.1 mt -71.27 -32.27 68.5 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.416 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.46 -44.56 96.12 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.288 0.949 . . . . 0.0 109.71 173.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.35 -47.89 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 118.794 0.725 . . . . 0.0 109.638 174.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -61.12 -26.73 67.87 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -87.9 -28.95 21.22 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.118 0.967 . . . . 0.0 111.515 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.11 -43.35 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-N 119.089 0.859 . . . . 0.0 109.507 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 p -142.01 146.77 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.03 0.932 . . . . 0.0 110.39 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -144.49 138.93 27.95 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.02 1.328 . . . . 0.0 107.424 169.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.73 29.53 49.72 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.573 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.48 19.88 79.73 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 118.201 1.001 . . . . 0.0 113.417 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 61.3 t -130.94 133.59 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.6 pt -64.61 146.91 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.84 -12.35 3.75 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.888 0.875 . . . . 0.0 111.401 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.87 156.0 43.26 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 169.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.7 m -151.76 41.66 0.69 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.422 1.089 . . . . 0.0 109.735 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -142.36 120.5 7.44 Favored Pre-proline 0 C--O 1.235 0.299 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 174.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.81 -28.93 19.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.237 1.958 . . . . 0.0 111.775 -169.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -70.98 -39.96 72.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.78 -41.39 75.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 118.89 0.768 . . . . 0.0 109.609 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 42.1 t -55.3 -56.27 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.16 -34.6 71.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 118.979 0.809 . . . . 0.0 110.819 -174.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -59.17 -50.77 72.76 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.039 0.836 . . . . 0.0 109.904 176.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -62.05 -40.3 95.29 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.881 -0.512 . . . . 0.0 111.135 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 65.3 t -64.07 -37.48 79.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.777 0.717 . . . . 0.0 110.654 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.35 -37.71 71.67 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.755 1.162 . . . . 0.0 111.071 175.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.0 tp -70.18 -26.09 63.74 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.48 1.912 . . . . 0.0 112.698 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 C-N-CA 124.861 1.264 . . . . 0.0 112.184 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 . . . . . 0 C--O 1.234 0.269 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 m -65.35 -41.21 94.08 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 169.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -139.36 139.3 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 123.85 0.86 . . . . 0.0 108.739 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -83.53 -37.83 22.53 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 169.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.61 168.28 20.17 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 118.513 0.597 . . . . 0.0 112.125 -173.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mt -133.28 137.47 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 104.94 -2.244 . . . . 0.0 104.94 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.9 mt -133.76 157.7 45.2 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.521 0.728 . . . . 0.0 109.373 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.489 ' CG2' HD11 ' A' ' 75' ' ' LEU . 9.8 mm -138.31 119.77 17.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.368 -2.827 . . . . 0.0 103.368 169.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -122.54 144.73 48.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.705 0.764 . . . . 0.0 109.158 -174.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -67.87 169.7 9.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.767 169.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -77.22 36.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.883 2.073 . . . . 0.0 111.389 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -149.62 7.26 0.65 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.278 2.231 . . . . 0.0 110.816 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.19 47.1 74.9 Favored Glycine 0 C--N 1.343 0.946 0 O-C-N 121.053 -1.029 . . . . 0.0 110.548 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -122.99 133.26 54.37 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 108.873 -177.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -64.76 119.38 10.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -173.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.1 mt -92.42 -42.38 9.79 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 159.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -148.65 154.69 40.03 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.803 0.841 . . . . 0.0 109.886 171.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.11 148.98 22.56 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -140.88 137.09 32.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 171.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -124.26 146.87 48.49 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -130.09 3.83 4.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.751 0.82 . . . . 0.0 110.992 -176.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -136.49 153.13 51.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.667 0.787 . . . . 0.0 111.054 -174.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.37 -0.49 12.54 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.285 2.234 . . . . 0.0 113.076 -173.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 p -65.6 -38.21 88.8 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.992 -1.068 . . . . 0.0 111.578 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -143.41 64.69 14.1 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.031 0.832 . . . . 0.0 110.467 -177.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -86.78 -1.02 8.11 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.851 2.367 . . . . 0.0 113.083 -175.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.6 m -133.71 137.51 45.31 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.399 1.08 . . . . 0.0 109.224 -169.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -50.64 -44.41 25.4 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 125.048 1.339 . . . . 0.0 113.47 -169.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -57.98 -45.77 86.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.667 0.667 . . . . 0.0 111.135 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.08 -35.98 64.28 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -60.26 -52.56 64.77 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.178 0.591 . . . . 0.0 109.887 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -57.78 -39.73 78.18 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.595 0.758 . . . . 0.0 110.647 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.65 83.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.098 0.559 . . . . 0.0 110.184 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -64.08 -38.66 91.87 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.44 0.696 . . . . 0.0 110.952 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -60.21 -46.56 89.33 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.631 1.972 . . . . 0.0 110.711 174.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.89 -46.29 91.2 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.026 0.83 . . . . 0.0 110.228 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -47.04 77.65 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.503 0.721 . . . . 0.0 110.752 177.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.81 -51.34 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.035 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -60.66 -46.56 89.87 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.892 0.769 . . . . 0.0 110.272 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -55.37 -43.71 75.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.455 1.102 . . . . 0.0 111.736 178.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -75.24 -49.73 18.4 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.999 0.52 . . . . 0.0 110.417 -177.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.1 p -68.57 -30.66 69.47 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.731 -0.605 . . . . 0.0 111.887 -172.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -58.22 -23.85 57.16 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.291 -0.881 . . . . 0.0 111.541 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.41 20.95 17.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.487 1.515 . . . . 0.0 110.339 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 84.4 m -125.29 156.6 38.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 108.949 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -84.62 35.1 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.526 1.53 . . . . 0.0 112.679 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.7 m 65.86 -176.91 0.19 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.249 1.82 . . . . 0.0 113.446 178.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.312 9.6 pt-20 56.31 -42.11 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 131.536 3.934 . . . . 0.0 117.006 -176.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.7 tt -158.02 151.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 120.245 1.384 . . . . 0.0 110.024 -173.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.81 177.74 9.27 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.434 1.893 . . . . 0.0 108.291 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 tt -140.57 125.61 18.43 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 170.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -77.29 -65.88 0.9 Allowed 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -169.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -142.72 4.04 1.49 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.195 1.798 . . . . 0.0 110.915 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.48 -40.95 0.67 Allowed Glycine 0 CA--C 1.525 0.666 0 C-N-CA 125.773 1.654 . . . . 0.0 109.319 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.84 126.91 29.96 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 170.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.1 m -80.22 146.21 31.84 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.4 p -136.71 121.15 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.42 142.4 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.865 -2.642 . . . . 0.0 103.865 168.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.42 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 16.2 p90 -152.43 167.11 29.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.555 0.693 . . . . 0.0 110.892 176.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -154.78 154.26 32.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -172.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -140.01 130.93 26.1 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -149.92 148.21 28.83 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.179 0.591 . . . . 0.0 109.633 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.4 mp 53.28 -89.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.772 2.029 . . . . 0.0 111.147 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -147.6 33.97 0.86 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.772 2.029 . . . . 0.0 108.903 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.489 HD11 ' CG2' ' A' ' 18' ' ' ILE . 50.3 tp -140.19 150.65 44.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.69 1.596 . . . . 0.0 110.47 -168.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -126.28 144.76 50.68 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -129.61 143.83 51.0 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.284 1.834 . . . . 0.0 107.764 -173.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -149.52 150.35 32.17 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.459 1.027 . . . . 0.0 111.774 -172.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.5 t -139.58 119.66 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -104.53 138.01 31.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 106.187 -1.782 . . . . 0.0 106.187 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.68 176.73 31.54 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-O 122.369 0.983 . . . . 0.0 112.666 177.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.8 m -61.49 157.05 17.95 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.619 1.568 . . . . 0.0 112.328 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 m -72.92 34.38 0.07 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.01 2.124 . . . . 0.0 112.083 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -70.28 176.98 3.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.429 1.492 . . . . 0.0 111.355 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -63.96 -12.91 41.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.07 1.748 . . . . 0.0 112.963 -177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -144.75 161.61 38.8 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.85 0.86 . . . . 0.0 110.581 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -9.23 8.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.559 2.744 . . . . 0.0 110.202 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.23 -31.93 69.51 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.903 1.281 . . . . 0.0 110.609 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -64.56 -35.59 81.48 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.396 0.998 . . . . 0.0 111.96 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.96 -43.14 72.15 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 30.8 tpp -64.88 -33.88 77.05 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.131 0.572 . . . . 0.0 111.174 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.42 -50.41 67.7 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.749 1.22 . . . . 0.0 109.949 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.9 t -60.17 -44.97 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.336 0.516 . . . . 0.0 110.097 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.93 -53.01 63.17 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.339 0.656 . . . . 0.0 110.091 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -60.39 -43.54 96.56 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.884 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.15 -45.9 92.76 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.257 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.0 tp -64.37 -49.35 71.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.999 0.818 . . . . 0.0 110.406 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -59.46 -46.62 88.27 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.47 0.176 . . . . 0.0 110.847 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -69.23 -38.44 78.51 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 118.813 -0.613 . . . . 0.0 111.03 -176.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.1 m -59.5 -50.96 71.9 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.799 0.84 . . . . 0.0 110.803 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt -54.91 -45.97 74.82 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -61.33 -37.38 83.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.791 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -68.82 -55.51 10.95 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 120.091 1.314 . . . . 0.0 109.432 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -74.16 -36.97 64.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.699 -169.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.6 tp -82.93 -28.76 29.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.887 0.767 . . . . 0.0 111.918 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 40.11 54.01 2.74 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.771 1.628 . . . . 0.0 112.831 -171.052 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -135.16 -179.51 5.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.89 2.076 . . . . 0.0 106.914 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -1.49 12.39 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 177.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.313 11.9 m 48.47 38.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.161 2.184 . . . . 0.0 111.87 -174.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -66.21 171.26 4.87 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.259 1.023 . . . . 0.0 110.023 171.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -60.54 -37.74 82.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -62.04 -45.47 93.41 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.495 1.043 . . . . 0.0 110.003 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.78 -33.1 73.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.512 0.325 . . . . 0.0 111.125 -174.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.326 0.0 OUTLIER -81.16 -32.93 33.42 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.518 -1.364 . . . . 0.0 110.95 176.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.3 tp -60.95 -36.74 80.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.293 0.951 . . . . 0.0 111.22 169.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.12 -7.96 59.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.319 -0.863 . . . . 0.0 112.845 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.82 30.79 5.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.457 1.103 . . . . 0.0 112.702 175.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -41.07 -46.08 2.84 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.167 1.387 . . . . 0.0 112.667 174.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.98 -40.55 96.65 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.056 0.843 . . . . 0.0 111.451 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.8 -42.79 98.4 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.58 -49.56 75.97 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.414 1.086 . . . . 0.0 110.543 173.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -56.09 -47.25 78.36 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 118.693 0.679 . . . . 0.0 109.734 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.5 mt -67.74 -36.98 81.53 Favored 'General case' 0 CA--C 1.527 0.072 0 CA-C-O 118.859 -0.591 . . . . 0.0 111.121 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.55 -45.37 93.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.076 0.853 . . . . 0.0 110.054 175.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.07 -49.4 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 118.673 0.67 . . . . 0.0 109.348 176.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.49 -23.29 62.64 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.415 1.086 . . . . 0.0 113.05 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -97.21 -19.59 18.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.655 1.182 . . . . 0.0 111.809 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 61.2 mt -88.79 -40.86 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.394 0.997 . . . . 0.0 109.474 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.2 m -140.32 145.27 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.97 1.308 . . . . 0.0 109.539 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -144.61 134.32 23.57 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.625 1.57 . . . . 0.0 107.302 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.44 28.67 51.48 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.369 -0.684 . . . . 0.0 113.07 -176.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.09 15.98 81.12 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 118.23 1.015 . . . . 0.0 113.678 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 59.4 t -131.6 140.07 49.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 119.326 1.563 . . . . 0.0 107.517 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.0 pt -62.46 146.12 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.975 -0.453 . . . . 0.0 110.522 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.55 -5.39 3.29 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.739 0.815 . . . . 0.0 112.392 172.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -153.57 154.55 34.47 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 169.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.2 m -140.1 24.46 2.34 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.654 1.182 . . . . 0.0 110.856 -171.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -140.15 122.61 9.96 Favored Pre-proline 0 C--O 1.234 0.251 0 C-N-CA 124.476 1.11 . . . . 0.0 108.201 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.92 -30.45 16.89 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.379 2.053 . . . . 0.0 111.819 -169.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.28 -41.24 73.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 121.473 -0.767 . . . . 0.0 109.11 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.97 -39.48 87.22 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.676 0.671 . . . . 0.0 109.905 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.96 -55.59 11.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.57 -39.19 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.37 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -60.36 -46.55 89.56 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.513 1.051 . . . . 0.0 110.743 176.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -72.68 -31.79 65.31 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.862 1.21 . . . . 0.0 111.754 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.92 -41.49 89.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 119.393 0.997 . . . . 0.0 109.432 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.38 -35.78 71.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.033 0.533 . . . . 0.0 111.85 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.32 -25.97 59.88 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.889 0.875 . . . . 0.0 112.397 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.295 171.327 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 . . . . . 0 C--O 1.235 0.335 0 CA-C-O 120.741 0.305 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 m -60.41 -34.28 73.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.505 1.122 . . . . 0.0 110.414 176.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.45 142.38 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -96.16 -41.7 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.412 1.085 . . . . 0.0 109.593 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.15 168.33 20.95 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.401 0.546 . . . . 0.0 111.642 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.9 137.08 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 127.292 2.237 . . . . 0.0 104.986 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 mt -133.89 151.26 51.45 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.473 ' CG2' HD11 ' A' ' 75' ' ' LEU . 62.6 mt -136.83 120.49 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 103.691 -2.707 . . . . 0.0 103.691 169.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.6 mt -123.68 148.84 46.14 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.733 0.813 . . . . 0.0 108.818 -169.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.68 172.25 3.6 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.685 0.755 . . . . 0.0 109.439 170.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.89 7.07 0.41 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.389 1.876 . . . . 0.0 114.054 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -131.66 11.0 4.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.873 1.669 . . . . 0.0 110.839 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.46 4.37 83.36 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.271 -0.893 . . . . 0.0 113.538 176.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -69.72 130.51 42.53 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.024 1.412 . . . . 0.0 110.197 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -67.14 105.5 1.71 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.397 1.079 . . . . 0.0 110.595 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.9 mt -81.55 -43.96 17.99 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 166.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -147.08 152.91 39.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.037 0.935 . . . . 0.0 109.741 174.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.11 149.98 19.88 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.045 0.938 . . . . 0.0 108.875 168.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -143.18 139.9 30.53 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 125.564 1.546 . . . . 0.0 106.941 169.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -127.27 150.11 49.71 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -129.29 -2.84 4.99 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -171.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -138.04 173.11 11.98 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.141 0.882 . . . . 0.0 110.921 -176.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -72.09 61.99 0.45 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.799 2.439 . . . . 0.0 109.044 174.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.6 m -154.31 91.99 1.47 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.638 -3.097 . . . . 0.0 102.638 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 55.43 60.9 8.91 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.377 1.471 . . . . 0.0 111.042 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -79.98 -2.73 12.3 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.5 2.133 . . . . 0.0 113.731 -175.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -136.22 141.88 44.01 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.379 0.99 . . . . 0.0 109.853 -169.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.2 t -43.92 -52.05 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 126.529 1.932 . . . . 0.0 113.326 -169.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -58.92 -42.72 90.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.527 0.603 . . . . 0.0 111.206 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.69 -32.39 63.91 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.678 0.391 . . . . 0.0 110.175 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -63.93 -48.83 74.98 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 123.232 0.613 . . . . 0.0 109.848 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -58.48 -35.74 72.66 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 118.754 0.706 . . . . 0.0 111.39 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.74 -48.74 70.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -63.3 -37.44 87.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.866 0.466 . . . . 0.0 111.189 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.7 -45.2 83.71 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.88 1.672 . . . . 0.0 111.004 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -60.8 -44.55 96.71 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.939 -0.475 . . . . 0.0 109.902 173.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.36 -46.51 79.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.251 0.62 . . . . 0.0 111.355 174.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.411 HD13 HD22 ' A' ' 62' ' ' LEU . 2.5 mm -57.59 -55.7 19.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 C-N-CA 124.468 1.107 . . . . 0.0 108.312 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -64.92 -41.04 95.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.982 0.356 . . . . 0.0 110.539 -175.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -59.42 -41.04 88.61 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.866 -0.521 . . . . 0.0 111.804 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -81.3 -45.71 15.8 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.22 0.463 . . . . 0.0 110.346 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.6 p -70.44 -26.89 63.86 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -169.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -74.2 -3.82 32.18 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.248 1.385 . . . . 0.0 112.091 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.3 mtt-85 -113.58 16.39 18.71 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 110.075 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -131.89 157.64 43.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.108 1.363 . . . . 0.0 108.599 -169.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.01 85.55 4.23 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.477 1.111 . . . . 0.0 109.67 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.5 m -47.07 136.85 8.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.051 1.74 . . . . 0.0 115.509 -169.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.06 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.454 1 C-N-CA 132.906 4.482 . . . . 0.0 107.433 173.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.29 156.82 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.561 1.544 . . . . 0.0 108.485 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.36 171.02 18.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.752 2.021 . . . . 0.0 108.721 174.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.8 tp -133.45 114.31 13.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.411 HD22 HD13 ' A' ' 48' ' ' ILE . 10.9 mp -114.24 98.82 7.17 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -174.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 57.72 14.33 2.39 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.224 1.81 . . . . 0.0 114.193 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.43 -31.2 2.9 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.683 1.611 . . . . 0.0 111.768 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.7 mt -83.28 129.94 35.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.433 1.116 . . . . 0.0 109.208 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -74.76 141.66 44.39 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 171.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 97.5 t -137.54 131.51 44.06 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.093 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.5 m -118.38 144.75 25.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 169.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -162.18 164.3 27.9 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 111.803 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -150.04 175.01 12.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.024 0.93 . . . . 0.0 108.594 169.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.3 p -139.61 145.35 38.43 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -145.69 137.9 25.52 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 11.8 mt 64.77 -82.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.21 1.804 . . . . 0.0 110.896 170.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -152.9 28.8 0.52 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.392 1.877 . . . . 0.0 108.934 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.473 HD11 ' CG2' ' A' ' 18' ' ' ILE . 47.6 tp -139.4 146.3 39.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 125.984 1.714 . . . . 0.0 109.428 -168.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -126.07 145.97 50.11 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.142 1.377 . . . . 0.0 107.482 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -136.21 138.07 41.5 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 -170.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -145.85 149.3 34.03 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.875 0.87 . . . . 0.0 111.359 -170.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.8 t -138.15 138.62 43.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 169.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.08 139.25 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -172.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -156.81 177.7 33.6 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-O 122.118 0.843 . . . . 0.0 112.594 -173.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.4 m -59.54 162.24 5.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.678 1.591 . . . . 0.0 112.452 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -71.84 27.46 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.698 1.999 . . . . 0.0 112.207 171.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -71.78 173.46 8.17 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.384 1.073 . . . . 0.0 112.142 -169.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.38 -7.59 38.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.74 1.616 . . . . 0.0 113.328 -172.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -141.8 159.87 41.33 Favored 'General case' 0 C--N 1.339 0.126 0 CA-C-N 119.061 0.846 . . . . 0.0 110.36 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.49 -6.57 10.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.322 2.249 . . . . 0.0 110.317 173.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -36.36 71.81 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.961 1.304 . . . . 0.0 111.099 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -65.86 -33.95 77.02 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.871 0.76 . . . . 0.0 111.675 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 34.3 mt -73.53 -42.48 61.69 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.0 mmt -56.64 -40.17 74.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.011 0.524 . . . . 0.0 110.06 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.89 -49.33 73.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.546 0.738 . . . . 0.0 109.887 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.0 t -60.14 -45.53 95.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 118.118 0.417 . . . . 0.0 110.166 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.5 tp -60.02 -49.29 78.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 122.903 0.481 . . . . 0.0 110.366 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.26 -42.02 96.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.846 -0.597 . . . . 0.0 110.594 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.2 m -60.11 -48.51 81.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.896 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 44.8 tp -64.86 -46.47 81.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.566 1.075 . . . . 0.0 111.155 -176.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.29 -46.88 88.31 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 122.999 0.52 . . . . 0.0 110.916 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.26 -26.4 52.45 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.33 -0.856 . . . . 0.0 111.641 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.7 m -62.98 -50.29 71.37 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.134 0.879 . . . . 0.0 110.313 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.2 mt -52.0 -47.75 64.79 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -58.92 -25.57 63.57 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.706 -1.14 . . . . 0.0 113.909 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -85.58 -53.5 5.13 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 121.041 1.746 . . . . 0.0 110.951 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -75.18 -38.11 60.98 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.598 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 tp -82.0 -39.1 24.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.959 0.504 . . . . 0.0 110.062 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.272 26.0 ptt-85 39.05 53.02 2.08 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.162 1.785 . . . . 0.0 112.237 -178.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -131.96 -169.82 2.28 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 128.215 2.606 . . . . 0.0 105.703 169.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -72.48 7.3 1.9 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.296 16.8 m 44.76 41.05 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.914 2.086 . . . . 0.0 112.164 -171.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -73.5 160.31 31.89 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.262 1.025 . . . . 0.0 109.485 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 33.4 pttt -60.37 -32.49 71.35 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -172.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -37.44 75.05 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.761 0.424 . . . . 0.0 110.258 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.74 -34.83 72.29 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.319 173.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -60.42 -45.38 93.82 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.962 -1.086 . . . . 0.0 110.441 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.79 -39.34 73.92 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.66 0.784 . . . . 0.0 111.094 175.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -63.66 -25.61 68.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.09 27.38 5.4 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 118.787 0.721 . . . . 0.0 112.689 -171.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -40.7 -48.82 3.02 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 125.074 1.349 . . . . 0.0 112.247 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.41 -40.29 96.8 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.819 0.736 . . . . 0.0 111.722 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.17 -44.33 97.87 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.79 -50.0 75.57 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.464 1.105 . . . . 0.0 110.322 175.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -54.91 -48.78 72.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.667 0.667 . . . . 0.0 109.897 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.91 -37.52 84.51 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.181 0.592 . . . . 0.0 111.194 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.81 90.38 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.655 0.661 . . . . 0.0 109.867 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.3 t -57.31 -44.38 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.564 0.62 . . . . 0.0 109.529 175.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -71.66 1.48 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.133 0.973 . . . . 0.0 113.433 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -118.28 -12.03 9.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.666 1.586 . . . . 0.0 111.34 172.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.6 mt -88.06 -40.57 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 24.0 t -133.69 145.61 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.319 1.048 . . . . 0.0 110.513 -169.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -144.87 130.7 19.16 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 125.846 1.658 . . . . 0.0 106.898 168.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.78 29.61 55.0 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 119.398 -0.668 . . . . 0.0 113.868 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.65 16.22 80.43 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.288 1.044 . . . . 0.0 113.289 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.5 t -127.91 138.45 54.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.9 pt -66.2 147.06 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.6 pp -128.03 -11.69 5.3 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.246 1.018 . . . . 0.0 111.692 177.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -147.79 157.22 43.43 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 169.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 7.3 m -141.83 26.64 1.88 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.996 0.918 . . . . 0.0 110.862 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -141.97 128.76 11.24 Favored Pre-proline 0 C--O 1.236 0.346 0 C-N-CA 124.084 0.953 . . . . 0.0 108.501 177.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.48 -38.55 8.24 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.846 2.364 . . . . 0.0 113.67 -172.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.281 0.0 OUTLIER -76.36 -26.98 56.25 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.873 -1.142 . . . . 0.0 110.162 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 -66.18 -44.33 84.32 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.537 1.062 . . . . 0.0 109.618 169.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.4 t -54.88 -51.64 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 118.926 0.785 . . . . 0.0 109.541 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.39 -38.22 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.05 0.841 . . . . 0.0 110.693 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -62.92 -38.85 92.62 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.674 1.125 . . . . 0.0 110.947 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 25.2 mtt-85 -64.01 -46.73 83.21 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.925 0.784 . . . . 0.0 109.998 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.7 t -58.34 -41.41 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.95 -33.95 74.54 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.553 0.741 . . . . 0.0 111.994 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 29.9 mt -72.34 -32.15 66.25 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.042 0.937 . . . . 0.0 111.983 177.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.332 -0.842 . . . . 0.0 109.998 176.647 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 . . . . . 0 C--O 1.235 0.294 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 m -63.15 -38.59 91.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.312 1.845 . . . . 0.0 110.637 175.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.7 m -141.66 153.39 19.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 124.644 1.178 . . . . 0.0 108.036 175.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -111.75 -28.7 7.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 117.206 -1.378 . . . . 0.0 110.688 174.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.14 166.66 25.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.14 1.336 . . . . 0.0 112.38 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.4 mt -136.21 136.67 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mt -135.41 154.02 51.6 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.048 0.939 . . . . 0.0 108.682 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.9 mt -138.83 123.87 21.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 169.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.5 mt -129.15 149.07 51.11 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -171.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -65.61 172.68 3.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.548 170.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -74.4 30.05 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.906 2.083 . . . . 0.0 111.878 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -147.98 7.66 0.83 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.278 2.231 . . . . 0.0 110.79 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.54 10.06 86.51 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 121.001 -1.062 . . . . 0.0 113.105 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -72.35 129.68 38.97 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 118.751 1.276 . . . . 0.0 109.949 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.74 106.84 0.73 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 125.315 1.446 . . . . 0.0 109.996 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.6 -44.41 8.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 166.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -147.29 151.5 36.72 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.754 0.822 . . . . 0.0 109.531 172.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.89 145.12 15.27 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 169.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -146.98 146.85 30.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.939 1.295 . . . . 0.0 108.181 174.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -135.23 149.64 49.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.259 1.424 . . . . 0.0 107.704 -174.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -132.62 0.34 3.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.674 1.19 . . . . 0.0 111.612 -174.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -131.9 160.63 35.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.845 0.858 . . . . 0.0 108.796 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.26 6.12 3.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.595 1.958 . . . . 0.0 112.897 -170.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 p -61.99 -48.63 79.47 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.823 1.249 . . . . 0.0 110.735 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -144.84 73.48 14.97 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.233 1.013 . . . . 0.0 109.212 -175.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -85.01 -2.51 9.59 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.459 2.106 . . . . 0.0 113.956 -173.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -137.65 140.73 41.01 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.368 0.985 . . . . 0.0 110.054 -169.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.23 -43.95 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.14 1.376 . . . . 0.0 113.229 -169.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -59.26 -38.29 79.71 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 117.799 0.272 . . . . 0.0 111.428 -176.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -85.84 -32.51 21.69 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.012 0.369 . . . . 0.0 110.236 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.6 -51.88 66.71 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 123.269 0.628 . . . . 0.0 110.201 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -60.41 -31.67 70.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.546 -0.721 . . . . 0.0 111.348 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.81 -48.13 67.13 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -61.51 -36.55 80.84 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.031 0.532 . . . . 0.0 111.055 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -66.83 -44.08 82.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.602 1.561 . . . . 0.0 111.311 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -60.71 -44.11 97.0 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.677 -0.639 . . . . 0.0 110.014 172.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.66 -45.95 81.37 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.599 0.76 . . . . 0.0 111.224 174.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.62 -53.35 45.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 C-N-CA 124.259 1.024 . . . . 0.0 108.474 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -62.5 -46.05 90.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.477 0.58 . . . . 0.0 110.362 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 -56.09 -42.45 76.76 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.997 0.919 . . . . 0.0 111.915 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -78.69 -47.83 16.17 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.171 0.589 . . . . 0.0 110.156 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.0 p -66.88 -30.38 70.52 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.54 -0.725 . . . . 0.0 111.851 -175.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -59.71 -20.72 58.24 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.363 -0.835 . . . . 0.0 112.23 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -108.58 17.63 21.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.842 1.657 . . . . 0.0 110.433 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 56.4 m -121.61 163.33 19.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.89 1.276 . . . . 0.0 108.942 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -95.63 25.5 4.52 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.076 1.75 . . . . 0.0 113.333 -169.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.0 m 73.82 176.88 0.24 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.315 1.846 . . . . 0.0 113.227 172.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.319 10.5 pt-20 56.33 -43.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 131.072 3.749 . . . . 0.0 116.354 -173.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -148.11 155.85 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 120.303 1.411 . . . . 0.0 109.766 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.85 167.03 27.74 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.248 2.219 . . . . 0.0 108.133 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 tp -135.08 116.07 14.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mp -117.35 97.29 5.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -172.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 57.45 15.92 2.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.225 1.81 . . . . 0.0 114.082 171.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.99 -28.36 3.91 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.7 1.619 . . . . 0.0 111.971 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.3 mt -82.26 128.27 34.02 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.474 1.137 . . . . 0.0 109.178 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.8 m -75.88 138.24 40.94 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 172.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.9 t -136.9 133.48 48.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.8 m -118.87 146.85 22.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 169.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -158.16 162.77 37.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.166 0.508 . . . . 0.0 110.981 -175.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -148.16 174.76 11.64 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.236 1.014 . . . . 0.0 108.418 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -139.76 146.58 39.69 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 169.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.1 m -142.45 137.66 30.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.89 0.876 . . . . 0.0 108.691 177.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.8 mt 63.17 -76.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 127.26 2.224 . . . . 0.0 110.805 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -156.37 31.35 0.33 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.719 1.608 . . . . 0.0 109.999 176.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.1 tp -140.17 149.46 43.0 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.293 1.437 . . . . 0.0 109.421 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -124.19 149.97 45.75 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.537 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -139.77 142.91 36.72 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.369 1.468 . . . . 0.0 107.862 -172.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -147.44 152.43 38.08 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.666 0.786 . . . . 0.0 111.189 -170.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.7 t -138.9 140.14 39.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 169.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.47 140.56 48.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.54 -179.86 34.64 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-O 122.664 1.147 . . . . 0.0 112.074 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.4 m -64.69 164.74 11.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.735 1.614 . . . . 0.0 112.557 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.2 p -74.02 37.93 0.1 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.997 2.119 . . . . 0.0 111.377 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -68.03 169.4 10.15 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.577 1.151 . . . . 0.0 110.819 -175.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.48 -4.18 21.51 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.651 1.18 . . . . 0.0 113.558 -174.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -149.35 172.63 14.6 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.368 1.467 . . . . 0.0 108.786 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.38 -1.98 3.51 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.055 2.542 . . . . 0.0 110.256 -176.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -64.49 -30.9 71.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.737 1.215 . . . . 0.0 110.51 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -35.06 79.28 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.263 0.938 . . . . 0.0 111.497 172.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -69.37 -46.41 67.02 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.1 mmt -55.25 -41.35 72.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.39 174.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.13 -50.08 71.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.005 0.922 . . . . 0.0 110.038 -179.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.33 -43.77 97.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.217 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.2 tp -60.89 -48.9 79.69 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 118.482 0.583 . . . . 0.0 110.486 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -63.67 -44.11 94.73 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.351 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 92.5 m -60.35 -47.06 87.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.147 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.6 tp -64.86 -49.12 71.78 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 119.057 0.844 . . . . 0.0 110.787 -177.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.59 -42.36 98.75 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.175 0.443 . . . . 0.0 110.927 -177.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -73.14 -36.63 66.71 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.49 -0.756 . . . . 0.0 111.173 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 20.8 m -63.76 -43.34 96.71 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.971 0.805 . . . . 0.0 110.85 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.8 mt -53.7 -50.35 66.07 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.9 m -57.18 -38.69 73.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.368 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.6 -49.54 66.0 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.35 -0.833 . . . . 0.0 111.54 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 4.2 ptp -69.99 -34.98 74.03 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.379 0.99 . . . . 0.0 111.211 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.43 -43.14 64.26 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.868 0.467 . . . . 0.0 111.024 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 51.96 27.21 4.2 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.065 1.346 . . . . 0.0 112.437 -169.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -156.59 -175.62 5.53 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.177 2.191 . . . . 0.0 107.676 177.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -46.85 123.45 5.18 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.992 1.317 . . . . 0.0 110.233 174.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 17.2 m -84.91 51.05 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.993 1.317 . . . . 0.0 108.974 171.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.11 178.21 7.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.364 1.066 . . . . 0.0 111.652 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -47.73 -54.28 12.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.65 1.18 . . . . 0.0 112.718 -175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -65.04 -41.37 95.28 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.313 0.506 . . . . 0.0 109.733 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.83 76.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.151 0.581 . . . . 0.0 111.97 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -69.54 -49.56 53.21 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 123.984 0.914 . . . . 0.0 110.253 171.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.6 tp -56.33 -37.41 69.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.808 0.843 . . . . 0.0 111.263 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -81.98 -3.31 54.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.543 0.737 . . . . 0.0 112.339 -178.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -132.91 22.43 4.19 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.786 1.235 . . . . 0.0 112.209 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -43.4 21.36 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.207 1.003 . . . . 0.0 111.724 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.26 -42.88 92.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.853 0.752 . . . . 0.0 111.466 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.14 -41.49 99.7 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 177.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.16 -48.92 78.79 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.559 1.144 . . . . 0.0 110.672 173.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.09 -45.52 83.29 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 118.808 0.731 . . . . 0.0 109.683 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.68 -35.38 78.73 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.164 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.25 89.7 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 119.081 0.855 . . . . 0.0 110.145 175.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.1 t -57.52 -47.74 84.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.11 -21.73 63.99 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.487 1.115 . . . . 0.0 113.158 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -97.64 -22.8 16.28 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.277 1.031 . . . . 0.0 111.562 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 67.4 mt -83.13 -45.29 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.3 0.954 . . . . 0.0 108.976 177.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 m -139.89 153.26 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.413 1.085 . . . . 0.0 110.684 -171.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -149.32 140.69 23.24 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.347 1.459 . . . . 0.0 107.85 169.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.45 28.01 54.84 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.464 -0.631 . . . . 0.0 113.463 177.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.68 17.79 79.57 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.194 0.997 . . . . 0.0 113.41 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 56.4 t -132.41 142.08 43.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 119.07 1.435 . . . . 0.0 107.383 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.6 pt -65.18 151.21 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 O-C-N 121.976 -0.452 . . . . 0.0 110.284 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 pp -134.32 -10.58 2.52 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.867 0.867 . . . . 0.0 111.939 170.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -149.01 155.61 41.04 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.3 m -140.31 23.56 2.35 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.241 1.417 . . . . 0.0 110.878 -170.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -140.46 125.1 10.91 Favored Pre-proline 0 C--O 1.236 0.356 0 C-N-CA 124.208 1.003 . . . . 0.0 108.865 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.88 -34.31 5.4 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.322 2.015 . . . . 0.0 113.924 -169.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.308 2.3 pp0? -76.11 -27.3 57.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.945 -1.097 . . . . 0.0 110.304 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -67.54 -45.29 76.1 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.357 0.98 . . . . 0.0 109.501 169.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.5 t -54.21 -56.52 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.58 -33.47 63.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.237 0.926 . . . . 0.0 110.656 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -50.31 74.24 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.334 0.97 . . . . 0.0 109.824 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -69.07 -30.92 69.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.996 1.271 . . . . 0.0 112.462 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.65 -43.92 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.661 1.119 . . . . 0.0 109.742 171.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.66 -31.08 66.43 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.095 0.558 . . . . 0.0 111.884 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.6 tp -68.76 -33.96 74.78 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 125.696 1.598 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 63.5 mtt85 . . . . . 0 C--O 1.249 1.052 0 O-C-N 123.383 0.427 . . . . 0.0 110.405 173.547 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 . . . . . 0 C--O 1.236 0.388 0 N-CA-C 111.69 0.256 . . . . 0.0 111.69 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 p -69.01 -37.52 78.73 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.4 m -139.82 157.56 26.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 174.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -121.94 -28.83 4.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.589 1.155 . . . . 0.0 111.058 -172.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -158.04 163.94 37.21 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.704 1.138 . . . . 0.0 110.689 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.8 mt -135.06 135.16 52.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.2 mt -133.91 149.31 51.29 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.92 116.72 14.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 103.592 -2.744 . . . . 0.0 103.592 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.8 mt -124.44 145.38 49.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.08 169.03 7.45 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.304 0.574 . . . . 0.0 110.305 169.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -13.77 1.93 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -178.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -112.99 5.9 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.649 1.18 . . . . 0.0 110.844 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.99 7.27 59.85 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 125.021 1.296 . . . . 0.0 112.666 173.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.44 131.69 45.16 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 119.252 1.526 . . . . 0.0 109.738 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -58.21 127.49 32.37 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.9 mt -107.84 -40.16 5.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 161.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -148.08 153.11 38.46 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 123.382 0.673 . . . . 0.0 109.713 170.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.5 145.9 19.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.208 1.003 . . . . 0.0 108.449 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -144.98 139.15 27.3 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.873 1.669 . . . . 0.0 106.77 176.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -128.63 151.02 49.96 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.928 1.291 . . . . 0.0 108.18 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -134.04 22.3 3.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.698 1.999 . . . . 0.0 108.4 174.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.72 147.98 48.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.652 1.581 . . . . 0.0 111.39 -168.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -96.73 -6.87 35.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.521 1.528 . . . . 0.0 111.953 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.5 m -70.68 -38.22 73.72 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.31 -0.869 . . . . 0.0 109.649 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -136.41 67.59 60.32 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 125.029 1.332 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -87.77 -1.33 7.34 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.768 2.312 . . . . 0.0 113.645 -176.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.8 m -135.23 141.0 45.71 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.065 0.848 . . . . 0.0 110.22 -169.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -46.03 -50.03 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.422 1.889 . . . . 0.0 112.736 -169.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -55.83 -47.29 77.46 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.144 0.429 . . . . 0.0 111.304 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -79.27 -32.42 43.67 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -177.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.34 -50.83 72.04 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 123.439 0.696 . . . . 0.0 110.624 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -62.7 -31.84 72.82 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.972 0.806 . . . . 0.0 111.132 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.95 72.15 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.914 -0.491 . . . . 0.0 110.007 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.91 -42.96 99.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.24 0.616 . . . . 0.0 110.223 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.14 -42.7 91.28 Favored 'General case' 0 C--N 1.334 -0.092 0 C-N-CA 126.562 1.945 . . . . 0.0 112.063 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -59.72 -43.32 94.22 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 118.996 0.816 . . . . 0.0 109.594 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -45.01 91.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 118.055 -0.974 . . . . 0.0 111.627 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.25 -55.55 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -58.61 -45.51 89.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.897 0.879 . . . . 0.0 110.702 -174.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -54.57 -45.52 73.54 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.267 1.027 . . . . 0.0 111.453 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 62' ' ' LEU . 15.7 mmmt -70.83 -49.58 44.82 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 119.065 -0.493 . . . . 0.0 110.348 -179.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 37.2 p -67.62 -31.3 71.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.54 1.064 . . . . 0.0 111.398 -173.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -59.27 -23.89 62.77 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.606 0.762 . . . . 0.0 111.304 172.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -120.71 36.06 4.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.315 1.446 . . . . 0.0 109.797 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.9 m -127.98 158.17 38.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.822 1.649 . . . . 0.0 106.581 170.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.75 -59.61 3.41 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.741 -0.6 . . . . 0.0 111.037 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m 177.57 -169.47 0.08 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.73 3.212 . . . . 0.0 107.286 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.322 10.4 pt-20 60.8 -47.91 0.11 Allowed 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 131.203 3.801 . . . . 0.0 117.196 169.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -158.41 152.72 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 121.024 1.738 . . . . 0.0 110.915 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.63 173.89 11.13 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.57 1.948 . . . . 0.0 108.775 170.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.3 tp -137.09 115.05 11.46 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.077 -2.194 . . . . 0.0 105.077 -176.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.406 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 1.5 mm? -75.62 -72.82 0.29 Allowed 'General case' 0 N--CA 1.457 -0.094 0 O-C-N 123.264 0.353 . . . . 0.0 110.138 -172.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -144.97 6.39 1.17 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.343 1.857 . . . . 0.0 110.881 -175.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 149.02 -40.27 0.9 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 126.086 1.803 . . . . 0.0 108.98 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.2 mt -68.61 142.93 55.0 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.9 m -107.86 146.44 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.9 p -139.67 118.77 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.3 m -86.41 150.05 3.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 106.282 -1.748 . . . . 0.0 106.282 169.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -153.73 166.09 33.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.582 0.706 . . . . 0.0 111.39 175.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.506 ' HE3' ' CE1' ' A' ' 98' ' ' PHE . 37.6 tttp -152.17 156.93 40.77 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.896 1.679 . . . . 0.0 106.758 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -136.13 135.53 39.33 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m -142.07 142.74 32.86 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.626 0.77 . . . . 0.0 109.382 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 mp 53.71 -85.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.156 2.182 . . . . 0.0 111.898 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -150.14 31.93 0.68 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.41 1.884 . . . . 0.0 108.806 -176.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.7 tp -140.38 145.21 36.81 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.494 1.918 . . . . 0.0 108.571 -169.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -127.79 140.25 52.16 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.679 1.192 . . . . 0.0 107.803 -179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -123.68 141.48 51.98 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.675 1.59 . . . . 0.0 107.47 -176.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -146.9 152.31 38.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 119.013 0.824 . . . . 0.0 110.524 -175.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 63.5 t -141.06 122.61 14.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 105.801 -1.925 . . . . 0.0 105.801 169.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -99.19 142.11 15.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.64 174.82 38.21 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-O 121.892 0.718 . . . . 0.0 112.4 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.31 176.5 3.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.148 1.379 . . . . 0.0 109.74 173.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.0 p -152.34 72.9 1.01 Allowed 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.377 -0.827 . . . . 0.0 109.383 172.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -54.94 -43.98 73.88 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.553 0.741 . . . . 0.0 111.037 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -145.17 -12.58 0.54 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.781 1.232 . . . . 0.0 112.173 172.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -156.52 175.69 13.7 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.565 1.146 . . . . 0.0 109.89 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.56 4.36 4.64 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.872 2.469 . . . . 0.0 110.585 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.2 -32.35 73.73 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 120.869 -1.144 . . . . 0.0 110.663 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -32.46 72.31 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.999 0.818 . . . . 0.0 111.682 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.89 -50.05 68.07 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 172.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.3 mmt -55.64 -41.24 73.28 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.538 0.335 . . . . 0.0 110.295 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.14 75.72 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.587 0.755 . . . . 0.0 110.287 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.91 -44.78 98.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 119.027 0.83 . . . . 0.0 110.07 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.82 -50.76 72.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.344 0.52 . . . . 0.0 110.616 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -64.24 -40.29 95.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 119.581 -0.247 . . . . 0.0 110.484 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.07 -45.56 93.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.474 0.71 . . . . 0.0 109.574 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 tp -65.08 -49.63 69.3 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.786 0.721 . . . . 0.0 111.114 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.506 ' CE1' ' HE3' ' A' ' 70' ' ' LYS . 68.5 t80 -60.93 -43.81 98.11 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.376 0.608 . . . . 0.0 110.88 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.59 -28.81 37.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.322 -0.861 . . . . 0.0 111.969 -174.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 23.3 p -66.72 -45.88 77.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 119.905 1.23 . . . . 0.0 110.01 172.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.1 mt -51.13 -49.43 60.81 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 m -58.85 -32.32 69.33 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.159 -0.924 . . . . 0.0 113.262 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -76.36 -50.64 13.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 120.603 1.547 . . . . 0.0 110.659 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -79.78 -32.21 40.88 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 119.357 -0.937 . . . . 0.0 112.95 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.503 HD21 ' HB1' ' A' ' 113' ' ' ALA . 18.3 tp -82.37 -32.54 29.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 118.058 0.39 . . . . 0.0 111.9 -170.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 46.36 47.79 13.69 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.083 1.353 . . . . 0.0 112.275 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -138.08 174.97 10.0 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.928 2.091 . . . . 0.0 105.903 169.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -72.25 15.32 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -178.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.28 24.0 m 44.06 41.7 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 127.148 2.179 . . . . 0.0 111.734 -173.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.6 170.57 15.51 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.205 1.002 . . . . 0.0 110.841 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -53.96 -42.09 68.52 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.476 0.71 . . . . 0.0 112.798 -176.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.7 tpp85 -66.57 -42.17 87.44 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-O 118.887 -0.578 . . . . 0.0 110.073 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.503 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -64.38 -39.03 93.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.899 0.772 . . . . 0.0 110.388 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.03 -50.97 71.6 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.614 0.766 . . . . 0.0 110.089 171.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.9 tp -58.0 -37.88 75.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.51 0.724 . . . . 0.0 111.684 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -67.61 -21.88 65.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.838 0.855 . . . . 0.0 112.864 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.43 24.6 4.8 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.259 0.936 . . . . 0.0 113.12 -171.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -45.33 3.44 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.197 1.399 . . . . 0.0 112.351 177.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -66.24 -38.2 87.33 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.427 1.012 . . . . 0.0 112.275 -178.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.84 -40.55 93.68 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 175.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.27 -48.91 77.67 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.139 0.976 . . . . 0.0 110.242 170.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -57.74 -46.56 84.29 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.9 mt -65.62 -38.88 90.68 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.472 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.97 -48.73 79.07 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-N 119.039 0.836 . . . . 0.0 109.631 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.0 t -56.72 -46.78 83.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.6 . . . . 0.0 109.458 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -68.71 -0.53 5.42 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.273 1.429 . . . . 0.0 113.56 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -120.64 -15.65 8.41 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.534 1.533 . . . . 0.0 111.34 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 65.7 mt -82.36 -37.04 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.306 1.043 . . . . 0.0 109.009 169.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.07 153.51 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.27 0.941 . . . . 0.0 110.384 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -150.54 136.94 18.76 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.307 1.443 . . . . 0.0 107.248 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.75 29.74 50.41 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.488 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.46 18.34 79.34 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-N 118.067 0.933 . . . . 0.0 113.7 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 41.4 t -126.47 133.03 69.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 174.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.5 pt -60.2 156.87 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.74 0.781 . . . . 0.0 111.422 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.0 mt -120.23 -22.24 6.66 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.291 1.836 . . . . 0.0 110.271 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -154.85 160.61 41.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.036 0.835 . . . . 0.0 109.973 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 m -135.52 14.04 3.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.998 1.319 . . . . 0.0 112.205 -169.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.79 123.29 10.61 Favored Pre-proline 0 N--CA 1.465 0.277 0 C-N-CA 123.72 0.808 . . . . 0.0 110.09 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.7 -44.63 13.12 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.728 2.286 . . . . 0.0 112.941 -170.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pp0? -73.92 -26.94 60.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 119.292 -0.963 . . . . 0.0 111.07 -175.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.05 -35.2 74.08 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.547 1.521 . . . . 0.0 110.539 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.7 -43.27 87.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 119.575 1.079 . . . . 0.0 109.24 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.43 -39.47 84.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.844 1.202 . . . . 0.0 111.028 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -61.04 -45.5 94.51 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.904 1.229 . . . . 0.0 110.155 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -59.04 -47.79 83.96 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.855 -0.528 . . . . 0.0 110.017 177.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 62.6 t -59.5 -41.93 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.496 0.718 . . . . 0.0 109.912 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.05 -34.86 77.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.186 0.595 . . . . 0.0 111.782 -178.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.33 -32.32 58.63 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.944 0.898 . . . . 0.0 111.929 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.838 178.834 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 . . . . . 0 C--O 1.234 0.253 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 m -54.06 -40.34 67.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.532 1.133 . . . . 0.0 111.267 -176.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.3 m -140.5 164.29 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.413 1.085 . . . . 0.0 108.692 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -122.8 -28.98 4.06 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 125.001 1.32 . . . . 0.0 110.191 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.75 166.9 27.9 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.753 1.16 . . . . 0.0 111.867 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -136.61 136.31 48.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -132.44 149.29 52.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 61.8 mt -139.1 120.39 15.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 104.175 -2.528 . . . . 0.0 104.175 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.8 mt -127.76 149.24 50.33 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.38 171.19 4.09 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -17.06 62.42 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.795 0.838 . . . . 0.0 112.354 173.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.5 -9.48 59.4 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.298 1.039 . . . . 0.0 112.095 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.44 86.01 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 0.0 112.274 -171.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -74.56 143.22 44.57 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.461 1.131 . . . . 0.0 109.941 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -59.61 133.02 55.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.626 0.648 . . . . 0.0 110.21 177.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt -106.31 -38.6 6.18 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 151.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.63 154.33 36.2 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.792 0.837 . . . . 0.0 110.632 172.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 146.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.433 1.093 . . . . 0.0 108.585 169.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.99 144.26 30.94 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 125.699 1.6 . . . . 0.0 107.505 171.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -128.81 150.47 50.3 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.554 1.542 . . . . 0.0 107.513 176.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -135.14 -0.86 2.7 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.816 0.846 . . . . 0.0 111.984 -174.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -135.02 160.2 39.07 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.885 0.766 . . . . 0.0 110.125 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -72.06 3.39 4.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.71 2.004 . . . . 0.0 113.194 -170.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -62.45 -49.04 77.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.414 1.085 . . . . 0.0 110.752 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -142.86 69.3 19.09 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.222 1.009 . . . . 0.0 109.537 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -85.74 -2.37 9.0 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.698 2.265 . . . . 0.0 113.627 -173.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.1 m -135.9 141.92 44.63 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 119.278 0.945 . . . . 0.0 109.617 -169.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.4 t -44.52 -52.82 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 126.469 1.908 . . . . 0.0 113.137 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -60.32 -45.0 94.96 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.624 0.647 . . . . 0.0 111.014 -175.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -69.98 -34.12 72.95 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -62.66 -51.5 67.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 118.625 -0.702 . . . . 0.0 109.857 174.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.97 -38.03 75.28 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.275 0.943 . . . . 0.0 111.496 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.17 -50.09 73.23 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.213 0.605 . . . . 0.0 109.609 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.52 -38.65 91.95 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.454 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.0 -45.09 96.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 126.444 1.898 . . . . 0.0 111.473 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.23 -40.03 93.52 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 121.546 -0.721 . . . . 0.0 110.035 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.476 HD21 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -57.03 -49.55 75.47 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.669 -0.681 . . . . 0.0 111.062 171.182 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -54.85 -50.71 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 124.703 1.201 . . . . 0.0 108.71 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -61.17 -49.32 77.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.67 0.388 . . . . 0.0 110.318 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -57.4 -49.37 76.41 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.893 0.477 . . . . 0.0 111.1 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm -60.46 -52.44 65.21 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.0 p -71.87 -32.16 67.19 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.903 -0.498 . . . . 0.0 111.885 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -63.12 -15.12 55.69 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.515 -0.74 . . . . 0.0 111.443 171.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -120.85 25.52 9.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.185 1.794 . . . . 0.0 109.837 -176.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 94.8 m -131.42 158.1 41.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.169 1.788 . . . . 0.0 107.711 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.18 -42.11 99.32 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 118.442 -0.79 . . . . 0.0 112.879 -170.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m 139.8 -177.71 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.805 1 C-N-CA 132.427 4.291 . . . . 0.0 108.878 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.324 10.2 pt-20 59.07 -44.03 0.07 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 131.226 3.81 . . . . 0.0 117.307 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.0 tt -150.23 155.48 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 120.61 1.55 . . . . 0.0 109.932 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.79 166.06 30.58 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.034 2.134 . . . . 0.0 108.541 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.66 115.71 14.96 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 104.331 -2.47 . . . . 0.0 104.331 171.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.476 HD13 HD21 ' A' ' 47' ' ' ASN . 1.5 pp -147.28 138.42 23.8 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.896 0.878 . . . . 0.0 109.565 -172.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 52.42 27.04 4.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.002 1.321 . . . . 0.0 112.196 -177.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.82 4.3 90.39 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.585 1.088 . . . . 0.0 113.525 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -108.74 138.85 44.39 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.453 1.501 . . . . 0.0 108.751 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 51.2 m -83.15 136.99 34.24 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 72.3 t -135.07 138.41 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 32.0 m -120.48 147.43 24.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -158.73 162.37 37.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.93 0.395 . . . . 0.0 110.958 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -149.71 175.83 11.23 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.457 1.103 . . . . 0.0 108.514 170.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.4 p -142.37 146.65 35.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 169.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -145.44 149.03 33.97 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.318 1.047 . . . . 0.0 109.115 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 mp 50.36 -90.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.151 1.781 . . . . 0.0 110.989 -172.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -148.55 36.71 0.81 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.411 1.884 . . . . 0.0 108.99 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 64.3 tp -134.14 145.21 49.06 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 127.24 2.216 . . . . 0.0 107.889 -169.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -125.02 144.98 50.12 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -133.96 141.21 47.2 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.126 1.37 . . . . 0.0 107.515 -173.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -145.46 147.52 32.28 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.958 0.903 . . . . 0.0 110.271 -171.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.0 t -134.77 137.32 51.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 105.329 -2.1 . . . . 0.0 105.329 169.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -127.98 133.86 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 105.117 -2.179 . . . . 0.0 105.117 -172.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -154.79 176.35 32.55 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 122.311 0.95 . . . . 0.0 112.695 -178.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.3 m -63.71 129.97 42.3 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 113.798 -1.201 . . . . 0.0 109.225 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -67.23 125.18 25.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -153.79 -175.57 5.43 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.003 0.921 . . . . 0.0 109.442 -169.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.8 -14.16 30.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.629 1.571 . . . . 0.0 112.789 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -144.47 159.24 43.08 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.264 1.026 . . . . 0.0 110.061 174.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.43 -4.16 7.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.056 2.542 . . . . 0.0 109.944 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.2 -31.73 71.49 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.941 1.296 . . . . 0.0 110.722 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.1 ptt? -64.92 -34.34 78.16 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.24 0.927 . . . . 0.0 111.664 173.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -70.11 -46.67 64.35 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.0 mmt -55.61 -40.58 72.29 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.281 174.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.13 74.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.066 0.946 . . . . 0.0 109.896 -178.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.5 t -61.94 -44.12 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-O 118.946 -0.55 . . . . 0.0 110.074 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.67 -46.89 87.8 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.907 0.776 . . . . 0.0 110.665 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -63.8 -45.17 90.88 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 119.04 -0.505 . . . . 0.0 110.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.9 m -60.45 -44.65 95.63 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.154 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.14 -55.72 29.1 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.615 0.643 . . . . 0.0 110.171 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -62.71 -43.95 97.47 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.899 0.38 . . . . 0.0 110.632 -173.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -71.7 -37.02 70.73 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.707 -0.621 . . . . 0.0 111.166 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 t -56.59 -52.38 65.06 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.159 0.984 . . . . 0.0 109.691 174.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 77.1 mt -53.77 -48.44 69.75 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.8 m -56.43 -35.58 68.0 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.613 -0.708 . . . . 0.0 112.332 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -74.59 -47.71 30.89 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.571 1.078 . . . . 0.0 111.233 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 10.2 ptp -69.35 -38.95 78.37 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -169.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.327 2.7 pp -97.26 -5.24 37.24 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -174.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 49.82 30.3 3.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -147.07 179.03 7.9 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.814 1.646 . . . . 0.0 106.879 169.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.87 137.1 57.88 Favored 'General case' 0 C--O 1.23 0.078 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.5 m -76.31 45.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.318 1.847 . . . . 0.0 111.604 -174.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.3 170.15 7.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.84 0.856 . . . . 0.0 111.16 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -54.79 -42.28 71.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.829 -0.545 . . . . 0.0 112.117 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -65.81 -42.49 90.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.485 0.584 . . . . 0.0 109.64 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.23 81.56 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.286 0.494 . . . . 0.0 110.355 -177.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.298 0.0 OUTLIER -74.84 -28.59 60.75 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.073 0.851 . . . . 0.0 111.587 -179.255 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.8 tp -60.89 -39.65 90.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.768 1.167 . . . . 0.0 110.774 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.26 -14.1 62.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.519 0.727 . . . . 0.0 112.179 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -127.75 24.9 6.06 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.267 1.027 . . . . 0.0 111.64 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.29 -45.76 24.43 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.405 1.082 . . . . 0.0 112.29 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.79 -43.53 96.06 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.05 0.841 . . . . 0.0 110.775 -178.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.48 -43.18 99.41 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.7 tp -56.47 -52.43 64.74 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.969 1.308 . . . . 0.0 109.993 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -59.11 -44.84 92.0 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.181 0.446 . . . . 0.0 109.879 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.09 -37.59 86.16 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.804 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.19 91.91 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.981 0.81 . . . . 0.0 110.463 175.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 48.6 t -54.68 -49.04 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -71.6 2.7 4.79 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.016 1.326 . . . . 0.0 113.631 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -119.09 -17.04 9.06 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.533 1.533 . . . . 0.0 111.305 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.33 -46.3 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.25 154.36 30.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.406 1.082 . . . . 0.0 110.8 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -147.3 137.86 23.43 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 125.926 1.69 . . . . 0.0 107.257 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.89 25.48 52.9 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.43 18.09 76.6 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-N 118.149 0.974 . . . . 0.0 113.363 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.6 t -131.8 139.47 50.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 119.343 1.572 . . . . 0.0 107.043 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 18.4 pt -64.07 150.08 10.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 O-C-N 122.147 -0.346 . . . . 0.0 110.667 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -132.79 -14.51 2.77 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.2 1.0 . . . . 0.0 111.928 174.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -149.54 154.07 38.16 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 169.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.4 m -137.12 26.66 2.94 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.561 1.144 . . . . 0.0 110.906 -169.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -143.07 125.74 8.9 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.42 -33.9 10.34 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.295 1.996 . . . . 0.0 111.643 -169.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.86 -40.36 79.38 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -178.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -68.27 -39.84 82.05 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.542 0.61 . . . . 0.0 109.795 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.9 t -55.58 -52.9 42.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 118.741 0.701 . . . . 0.0 109.47 173.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.59 -40.48 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.499 1.045 . . . . 0.0 110.11 -179.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -63.02 -40.21 97.08 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.032 0.833 . . . . 0.0 111.044 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -68.57 -42.32 78.48 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.506 -0.746 . . . . 0.0 110.281 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 53.2 t -57.51 -43.22 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 118.595 0.634 . . . . 0.0 109.409 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.1 -33.58 73.74 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.409 0.684 . . . . 0.0 111.914 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 31.3 mt -72.26 -31.3 65.65 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.197 0.999 . . . . 0.0 112.137 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.967 176.539 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 . . . . . 0 C--O 1.235 0.322 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 34.3 p -80.66 -44.02 19.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 p -122.27 121.57 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.745 1.218 . . . . 0.0 108.037 -169.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.465 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 68.0 mmtt -75.06 -42.16 57.51 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 123.655 0.782 . . . . 0.0 109.362 174.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.28 165.72 23.92 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.233 0.47 . . . . 0.0 111.196 -171.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.27 131.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.9 mt -130.41 148.16 52.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mt -138.54 118.84 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 173.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.7 mt -122.68 143.04 50.04 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -175.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.41 167.79 13.96 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 169.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -57.29 -22.03 38.94 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.67 -25.5 20.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.727 1.149 . . . . 0.0 111.305 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.81 6.97 5.79 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 126.046 1.784 . . . . 0.0 112.557 173.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.29 129.48 40.02 Favored 'General case' 0 C--N 1.338 0.075 0 CA-C-N 119.088 1.444 . . . . 0.0 109.789 -178.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -66.32 94.59 0.27 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 109.288 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -50.87 61.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 168.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -148.78 153.09 37.66 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -156.87 147.55 21.58 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 169.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.7 OUTLIER -143.51 147.89 35.17 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.077 1.351 . . . . 0.0 107.504 169.913 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -137.73 143.76 41.36 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.91 1.684 . . . . 0.0 106.482 -175.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.06 -2.99 5.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.262 1.025 . . . . 0.0 112.621 -173.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -131.04 162.71 29.21 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.842 0.746 . . . . 0.0 109.08 -177.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -71.72 7.27 1.56 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.833 2.053 . . . . 0.0 112.505 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 p -61.68 -52.7 63.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.46 1.504 . . . . 0.0 110.207 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -144.29 70.75 16.12 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 124.64 1.176 . . . . 0.0 109.039 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.02 -1.62 9.43 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 122.667 2.245 . . . . 0.0 113.69 -172.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 m -136.49 139.38 42.26 Favored 'General case' 0 C--N 1.34 0.174 0 C-N-CA 123.971 0.908 . . . . 0.0 109.773 -169.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.5 t -46.42 -49.1 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 126.066 1.746 . . . . 0.0 113.025 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -58.47 -43.31 88.85 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.722 0.692 . . . . 0.0 111.406 -176.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.14 -32.18 58.98 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.856 0.298 . . . . 0.0 110.299 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -62.48 -48.73 78.32 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.252 0.621 . . . . 0.0 110.231 175.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -59.79 -35.71 75.23 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.983 0.811 . . . . 0.0 111.178 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.05 -44.86 75.43 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.02 0.528 . . . . 0.0 109.961 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.77 -38.35 90.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.077 0.551 . . . . 0.0 111.005 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.75 -41.25 96.06 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.701 1.6 . . . . 0.0 110.872 177.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.3 mmtt -60.34 -45.9 91.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.708 -0.62 . . . . 0.0 109.769 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.2 -48.12 77.04 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.431 0.692 . . . . 0.0 111.176 174.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mm -56.68 -54.07 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 C-N-CA 124.41 1.084 . . . . 0.0 108.546 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -60.28 -48.99 79.37 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.174 0.59 . . . . 0.0 109.926 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -60.37 -39.66 88.02 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.517 1.127 . . . . 0.0 112.692 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt -73.37 -50.04 24.04 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 121.645 -0.659 . . . . 0.0 109.344 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.404 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 33.1 p -70.39 -31.87 69.28 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -69.11 -5.37 21.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.938 0.79 . . . . 0.0 112.527 173.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtp-105 -126.78 28.27 5.89 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.388 1.875 . . . . 0.0 109.353 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.495 HG21 ' HB2' ' A' ' 60' ' ' ALA . 99.4 m -134.47 158.17 44.59 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.913 1.685 . . . . 0.0 108.048 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 29.05 0.46 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.542 1.537 . . . . 0.0 113.324 -169.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m 67.81 -179.53 0.22 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.016 1.726 . . . . 0.0 113.319 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.7 pt-20 56.62 -43.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 131.362 3.865 . . . . 0.0 117.006 -176.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.6 tt -154.89 155.25 6.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 120.21 1.368 . . . . 0.0 109.772 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.495 ' HB2' HG21 ' A' ' 55' ' ' THR . . . -148.5 172.69 14.08 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.487 1.915 . . . . 0.0 108.389 172.087 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -134.43 121.24 20.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 103.64 -2.726 . . . . 0.0 103.64 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.2 mt -78.14 -69.08 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.062 -168.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -142.53 7.9 1.74 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.548 1.939 . . . . 0.0 110.281 -176.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.82 -43.73 0.78 Allowed Glycine 0 CA--C 1.525 0.662 0 C-N-CA 126.241 1.877 . . . . 0.0 108.703 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.6 mt -68.49 129.31 39.56 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.826 0.85 . . . . 0.0 109.889 174.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 85.3 m -78.76 148.13 33.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.4 p -140.13 130.9 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 171.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -101.3 144.8 12.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 25.7 p90 -160.11 162.16 33.97 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.004 0.366 . . . . 0.0 111.61 -175.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -154.46 -179.85 8.34 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 169.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -135.26 149.24 49.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 123.885 0.874 . . . . 0.0 109.094 170.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -146.44 142.2 27.9 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.3 mt 61.68 -84.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 126.703 2.001 . . . . 0.0 110.85 174.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -148.99 25.77 0.91 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.236 2.614 . . . . 0.0 109.737 -176.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.27 150.48 51.49 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.194 2.198 . . . . 0.0 109.581 -169.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -130.35 143.62 50.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.53 1.532 . . . . 0.0 107.582 170.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -135.89 137.42 41.41 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.801 1.24 . . . . 0.0 107.669 -170.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -144.08 144.6 31.69 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 -171.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 62.0 t -135.74 121.79 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.39 134.29 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 -173.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.465 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -149.42 172.39 29.44 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 122.005 0.781 . . . . 0.0 113.325 -174.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.5 m -64.72 164.16 12.65 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.466 -1.367 . . . . 0.0 109.277 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.9 m -129.01 29.12 5.24 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.915 0.886 . . . . 0.0 110.752 -169.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 38.8 p90 -61.69 -34.56 75.96 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.873 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -160.72 -33.31 0.05 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.484 0.584 . . . . 0.0 112.418 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.24 171.77 14.45 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.693 0.797 . . . . 0.0 111.487 -170.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.1 -2.5 2.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.888 2.475 . . . . 0.0 110.69 -174.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -66.16 -33.61 76.17 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 124.266 1.026 . . . . 0.0 110.714 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -32.49 74.08 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.643 0.656 . . . . 0.0 111.253 173.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.8 mt -70.25 -43.64 70.11 Favored 'General case' 0 C--O 1.23 0.067 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.8 mmt -55.82 -40.89 73.41 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.064 173.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -47.87 78.7 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.121 0.568 . . . . 0.0 110.468 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.25 -46.92 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.696 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 60.4 tp -60.07 -45.65 92.2 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.575 0.625 . . . . 0.0 110.514 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -63.24 -47.08 83.98 Favored 'General case' 0 C--N 1.338 0.094 0 CA-C-O 119.146 -0.455 . . . . 0.0 110.237 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.7 m -61.55 -44.66 96.63 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.192 0.451 . . . . 0.0 110.389 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.6 tp -60.5 -53.57 55.88 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.887 0.875 . . . . 0.0 110.791 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.82 -41.41 97.86 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.684 0.278 . . . . 0.0 110.908 -177.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -75.03 -31.81 61.42 Favored 'General case' 0 N--CA 1.456 -0.141 0 O-C-N 121.51 -0.744 . . . . 0.0 111.294 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -62.67 -47.75 82.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.916 0.78 . . . . 0.0 110.023 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.5 mt -51.7 -51.42 56.16 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -34.12 69.77 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -71.67 -41.55 68.56 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.645 1.111 . . . . 0.0 111.437 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -97.85 3.36 49.85 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -171.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.8 tp -141.32 58.19 1.52 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.208 1.803 . . . . 0.0 107.902 -172.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -69.54 49.83 0.09 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.49 2.316 . . . . 0.0 112.9 -171.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.7 pttt -137.55 -67.86 0.48 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.848 1.259 . . . . 0.0 109.318 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -159.45 149.19 18.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 174.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.5 m -90.91 50.42 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-O 121.809 0.814 . . . . 0.0 109.71 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.95 167.9 11.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.872 1.269 . . . . 0.0 111.275 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -49.15 -54.66 15.33 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.155 1.382 . . . . 0.0 112.743 -171.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -62.04 -42.64 99.4 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 122.462 0.305 . . . . 0.0 110.499 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.49 -38.58 87.56 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.388 0.54 . . . . 0.0 110.582 -177.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.79 -45.37 92.96 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 121.421 -0.799 . . . . 0.0 110.207 174.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 68.6 tp -57.28 -38.25 73.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.288 0.635 . . . . 0.0 111.322 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -71.5 -16.99 62.37 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.92 23.54 4.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.404 1.002 . . . . 0.0 112.685 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -37.41 -50.09 1.05 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.334 1.854 . . . . 0.0 113.179 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -62.12 -40.3 95.44 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.539 1.063 . . . . 0.0 111.377 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.76 -45.86 94.86 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 177.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.75 -51.08 71.48 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.021 0.928 . . . . 0.0 110.747 175.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -54.43 -48.39 71.73 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 109.6 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.78 -33.31 66.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.434 -175.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.84 -44.48 96.02 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 119.37 0.987 . . . . 0.0 109.843 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -58.04 -45.77 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.448 0.567 . . . . 0.0 109.482 175.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -3.02 6.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.687 1.195 . . . . 0.0 113.506 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -115.29 -17.97 11.19 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.222 1.409 . . . . 0.0 111.745 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 55.6 mt -86.1 -30.35 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.265 1.026 . . . . 0.0 109.179 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.6 t -139.97 147.59 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 125.245 1.418 . . . . 0.0 107.938 -170.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -143.31 130.84 21.16 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.86 1.264 . . . . 0.0 107.646 170.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.9 52.1 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.538 175.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.01 16.45 79.5 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-N 118.225 1.012 . . . . 0.0 113.684 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 57.4 t -127.87 142.32 44.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 44.2 pt -54.53 142.9 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.526 0.679 . . . . 0.0 110.562 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.53 -42.3 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.996 1.718 . . . . 0.0 108.317 -175.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -144.86 156.42 44.0 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.135 0.974 . . . . 0.0 108.716 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -135.29 24.92 3.51 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.152 1.381 . . . . 0.0 110.49 -172.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -141.84 118.1 7.18 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 124.377 1.071 . . . . 0.0 108.87 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 -32.57 11.59 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.701 2.267 . . . . 0.0 111.79 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.19 -40.44 86.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -69.63 -36.55 76.24 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.816 0.735 . . . . 0.0 110.298 177.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.7 t -56.78 -55.68 18.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 123.236 0.614 . . . . 0.0 109.396 175.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 34.1 m -67.18 -30.14 48.32 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 CA-C-N 119.2 0.909 . . . . 0.0 111.287 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.54 -51.88 67.56 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.017 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -62.53 -40.77 97.83 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.73 1.15 . . . . 0.0 110.844 178.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 t -56.66 -45.93 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.104 0.411 . . . . 0.0 110.384 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -79.62 -26.52 41.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.026 0.83 . . . . 0.0 111.452 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 63.7 tp -71.88 -22.29 61.53 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.396 1.879 . . . . 0.0 112.1 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.0 ptt-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.083 1.353 . . . . 0.0 113.167 178.632 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 . . . . . 0 C--O 1.237 0.436 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.7 p -66.85 -26.83 67.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 109.993 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -135.6 141.1 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -100.06 -27.34 13.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 117.682 -1.152 . . . . 0.0 109.723 173.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.27 166.09 28.19 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.56 1.073 . . . . 0.0 111.916 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.9 mt -134.01 137.19 52.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -134.11 150.79 51.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.405 HG22 HD11 ' A' ' 75' ' ' LEU . 61.0 mt -137.69 114.35 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 102.925 -2.991 . . . . 0.0 102.925 169.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 46.2 mt -117.29 147.78 42.27 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 122.238 1.018 . . . . 0.0 110.164 -169.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -68.85 172.55 6.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 113.449 -1.705 . . . . 0.0 107.928 169.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -78.08 35.6 0.21 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.05 2.14 . . . . 0.0 111.126 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -149.09 8.1 0.73 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.696 2.398 . . . . 0.0 110.838 178.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.11 47.91 69.29 Favored Glycine 0 C--N 1.342 0.872 0 O-C-N 120.883 -1.136 . . . . 0.0 110.767 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -123.97 126.7 46.77 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 118.013 0.906 . . . . 0.0 108.846 -178.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -60.61 107.98 0.76 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.78 0.832 . . . . 0.0 110.888 -177.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -74.12 -41.59 61.37 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 155.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -141.14 149.1 41.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.081 1.352 . . . . 0.0 108.208 171.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.55 144.02 16.55 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -148.23 147.63 29.59 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.013 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -135.49 149.11 49.44 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.624 1.57 . . . . 0.0 106.978 -176.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -133.54 -1.36 3.14 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.974 0.91 . . . . 0.0 111.92 -174.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -135.05 159.4 41.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.927 0.785 . . . . 0.0 110.036 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -73.53 2.28 8.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.021 2.129 . . . . 0.0 113.043 -169.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -59.64 -47.54 85.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.337 1.055 . . . . 0.0 110.724 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -144.87 79.38 12.11 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.53 1.132 . . . . 0.0 108.261 -177.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -92.67 -0.6 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.864 2.376 . . . . 0.0 113.504 -174.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 m -134.31 138.05 44.67 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.131 0.972 . . . . 0.0 109.814 -169.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.24 -44.85 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.257 1.423 . . . . 0.0 113.532 -169.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -61.14 -44.62 97.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 117.959 0.345 . . . . 0.0 110.646 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -78.9 -32.51 45.78 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.66 -50.1 73.86 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.355 0.525 . . . . 0.0 110.455 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -62.39 -33.46 74.8 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.064 -1.023 . . . . 0.0 111.153 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.5 73.69 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.946 -0.471 . . . . 0.0 109.866 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.17 -37.96 81.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.657 0.783 . . . . 0.0 110.699 175.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -63.33 -42.81 98.99 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.793 1.637 . . . . 0.0 110.997 176.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -61.36 -44.65 96.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.164 0.893 . . . . 0.0 110.447 172.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.489 HD21 HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -58.15 -45.48 87.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.077 0.551 . . . . 0.0 111.198 177.28 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.1 mm -58.28 -53.91 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.377 1.071 . . . . 0.0 108.394 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.19 -43.74 95.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.73 0.412 . . . . 0.0 110.813 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -56.03 -48.24 76.33 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.347 0.659 . . . . 0.0 110.641 174.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -61.67 -50.66 71.6 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 118.107 0.412 . . . . 0.0 109.925 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.9 p -71.74 -31.16 66.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.925 0.784 . . . . 0.0 111.801 -171.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -62.88 -16.53 59.16 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.718 0.69 . . . . 0.0 111.467 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -117.95 25.0 10.66 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.093 1.757 . . . . 0.0 109.814 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.8 m -133.52 158.54 42.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.312 1.845 . . . . 0.0 107.554 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.97 -48.15 80.09 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 118.443 -0.789 . . . . 0.0 112.371 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.0 m 153.91 -175.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 131.768 4.027 . . . . 0.0 108.192 -177.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.2 pt-20 59.62 -43.4 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 131.486 3.914 . . . . 0.0 117.427 173.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.9 tt -155.3 153.01 8.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 120.729 1.604 . . . . 0.0 110.024 -176.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.06 172.24 14.57 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 126.038 1.735 . . . . 0.0 108.429 170.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.5 tp -140.8 116.18 10.05 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 47' ' ' ASN . 8.7 mp -84.65 -155.85 0.22 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.447 1.499 . . . . 0.0 108.912 178.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.61 15.63 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.187 2.595 . . . . 0.0 114.205 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.55 -10.54 1.28 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 126.004 1.764 . . . . 0.0 112.1 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.2 mt -112.88 119.8 39.24 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.358 1.079 . . . . 0.0 109.319 -171.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.2 m -72.69 144.34 47.74 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 171.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 3.9 p -136.97 134.34 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.45 137.99 45.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -154.69 166.63 32.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 120.595 0.235 . . . . 0.0 111.027 -169.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -152.05 175.91 12.06 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 123.763 0.825 . . . . 0.0 108.913 169.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 m -141.15 133.4 28.07 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -144.46 145.75 32.07 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.48 0.712 . . . . 0.0 109.957 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.8 mp 49.31 -86.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.971 2.108 . . . . 0.0 111.614 -171.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -149.06 28.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.961 2.104 . . . . 0.0 108.978 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.405 HD11 HG22 ' A' ' 18' ' ' ILE . 57.5 tp -132.96 144.66 50.27 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.529 1.532 . . . . 0.0 109.198 -169.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -125.78 137.44 53.79 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -129.13 141.36 51.21 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.646 1.178 . . . . 0.0 108.214 -171.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -147.23 148.54 31.58 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.809 0.844 . . . . 0.0 110.866 -169.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.5 t -135.84 125.71 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 170.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.3 mp -114.78 137.67 47.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 -177.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.33 178.41 35.48 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-O 122.519 1.066 . . . . 0.0 113.294 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.9 m -65.27 133.84 52.33 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 112.972 -1.614 . . . . 0.0 107.798 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 m -78.56 48.17 0.77 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.836 1.254 . . . . 0.0 110.831 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -72.55 64.97 0.64 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.041 2.537 . . . . 0.0 110.617 -174.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 54.53 14.19 0.79 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.393 2.277 . . . . 0.0 113.754 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.76 160.67 25.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 126.833 2.053 . . . . 0.0 107.48 -171.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.98 -5.64 1.89 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.062 2.145 . . . . 0.0 110.047 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -61.25 -34.42 75.12 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.447 1.099 . . . . 0.0 110.671 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.38 -33.91 76.94 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.022 0.828 . . . . 0.0 112.054 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.5 mt -71.77 -41.91 67.82 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.1 mtp -60.29 -37.06 79.35 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.714 173.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.01 63.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.713 0.805 . . . . 0.0 109.851 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -61.56 -44.91 99.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 118.237 0.471 . . . . 0.0 109.869 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.89 -51.44 69.6 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 123.261 0.624 . . . . 0.0 109.744 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -62.16 -45.57 92.81 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.631 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 85.8 m -60.99 -42.81 99.14 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.083 0.856 . . . . 0.0 111.073 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.4 tp -68.56 -48.18 64.93 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.92 0.782 . . . . 0.0 110.794 -177.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -64.15 -40.29 95.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.941 -0.475 . . . . 0.0 110.824 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -77.21 -33.8 56.19 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.239 -0.913 . . . . 0.0 111.624 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.5 p -64.86 -42.26 95.01 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.729 1.15 . . . . 0.0 109.85 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.5 mt -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -61.13 -13.59 18.64 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -94.9 -37.75 11.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 120.611 1.55 . . . . 0.0 112.111 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -97.92 -0.95 43.95 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.0 tp -134.99 52.64 2.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.981 1.712 . . . . 0.0 109.206 -171.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -68.73 61.9 0.1 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.77 2.028 . . . . 0.0 112.627 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.428 ' HG3' ' H ' ' A' ' 108' ' ' ASN . 15.0 ptmt -138.29 -66.58 0.49 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.319 1.848 . . . . 0.0 106.952 169.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.428 ' H ' ' HG3' ' A' ' 107' ' ' LYS . 5.8 m-20 -163.6 150.04 11.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 129.102 2.961 . . . . 0.0 103.354 169.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.61 40.89 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 118.829 0.74 . . . . 0.0 109.962 171.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -86.2 172.74 10.29 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.242 1.017 . . . . 0.0 111.912 -173.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -54.81 -53.59 53.26 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 124.525 1.13 . . . . 0.0 112.51 -172.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.0 mmt180 -65.0 -39.23 93.15 Favored 'General case' 0 N--CA 1.463 0.202 0 O-C-N 121.979 -0.451 . . . . 0.0 110.19 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.53 -39.87 94.57 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.194 0.452 . . . . 0.0 111.228 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.303 0.0 OUTLIER -76.43 -29.78 57.14 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.98 -1.075 . . . . 0.0 110.864 178.39 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.6 tp -60.78 -36.14 78.25 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.726 0.694 . . . . 0.0 111.188 169.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -65.86 -25.72 67.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.679 -0.638 . . . . 0.0 112.711 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -131.01 31.9 4.39 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.823 0.849 . . . . 0.0 112.607 -173.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -39.18 -48.53 1.76 Allowed 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.816 1.646 . . . . 0.0 112.585 175.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -67.34 -35.45 79.4 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.676 0.671 . . . . 0.0 111.883 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.72 -42.53 99.76 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 172.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.75 -45.94 92.37 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.052 0.941 . . . . 0.0 111.23 173.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -54.99 -47.04 75.15 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.318 0.963 . . . . 0.0 109.788 175.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.3 mt -67.44 -32.8 73.91 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.673 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.59 -45.64 86.1 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.086 0.857 . . . . 0.0 110.151 174.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.33 -41.55 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 118.57 0.623 . . . . 0.0 109.924 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.91 -24.04 63.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.213 1.005 . . . . 0.0 112.574 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -91.85 -41.76 10.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.586 0.63 . . . . 0.0 110.927 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.65 -38.07 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 118.814 0.734 . . . . 0.0 109.481 -177.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.6 t -131.14 144.87 36.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.371 1.068 . . . . 0.0 109.21 -171.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -142.07 126.26 17.47 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 124.869 1.268 . . . . 0.0 107.687 169.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.92 30.29 59.97 Favored Glycine 0 CA--C 1.534 1.222 0 CA-C-O 119.361 -0.688 . . . . 0.0 113.35 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.32 12.21 84.79 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.335 1.067 . . . . 0.0 113.554 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.2 t -120.61 139.83 46.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 177.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.7 pt -56.4 138.82 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.196 0.522 . . . . 0.0 110.066 173.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -127.46 -35.62 2.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.581 1.553 . . . . 0.0 109.409 -171.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -138.93 151.64 47.07 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.5 m -139.24 29.25 2.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.776 1.231 . . . . 0.0 110.822 -169.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -137.98 121.69 11.57 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.31 -34.95 9.12 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.702 2.268 . . . . 0.0 113.634 -171.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -73.55 -38.35 65.27 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.162 0.892 . . . . 0.0 109.835 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -63.2 -37.23 86.41 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.167 0.894 . . . . 0.0 110.409 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.24 -53.52 38.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.686 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 26.3 m -66.5 -33.53 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 121.109 1.777 . . . . 0.0 112.263 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -61.6 -48.72 79.66 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.176 0.898 . . . . 0.0 109.554 177.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -70.21 -34.34 72.79 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.398 -0.814 . . . . 0.0 111.101 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 3.5 t -57.72 -45.77 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 121.394 -0.816 . . . . 0.0 109.633 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.05 -28.0 57.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 122.218 -0.301 . . . . 0.0 111.637 -175.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 54.3 mt -74.89 -26.57 59.75 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.286 1.034 . . . . 0.0 112.13 175.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 C--O 1.249 1.073 0 CA-C-N 119.14 0.882 . . . . 0.0 110.09 171.18 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -149.61 167.65 25.75 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.985 1.314 . . . . 0.0 108.56 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -156.51 163.15 39.74 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.868 1.667 . . . . 0.0 107.834 177.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 38.6 tp -61.56 -25.22 67.17 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.416 0.687 . . . . 0.0 112.025 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.8 mt -129.83 47.58 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 125.748 1.619 . . . . 0.0 106.68 178.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -58.29 -24.36 59.28 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.566 -0.708 . . . . 0.0 111.235 169.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -136.66 150.98 71.79 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 127.532 2.333 . . . . 0.0 105.787 169.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.89 55.67 4.49 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 125.216 3.944 . . . . 0.0 111.462 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.4 m -70.4 5.74 1.65 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.769 1.628 . . . . 0.0 113.311 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.8 pp -144.45 175.8 9.85 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 126.586 1.954 . . . . 0.0 109.101 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -130.12 143.71 50.94 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.444 1.097 . . . . 0.0 108.694 -173.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 61.4 p -67.29 -33.46 75.35 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 175.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.8 m -132.33 128.05 57.96 Favored 'Isoleucine or valine' 0 C--N 1.34 0.188 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 169.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.45 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 23.6 mtpp -86.5 -30.3 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 118.201 -0.904 . . . . 0.0 108.747 174.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.38 167.56 27.09 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 119.222 0.919 . . . . 0.0 111.564 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.2 mt -136.47 131.42 48.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 104.277 -2.49 . . . . 0.0 104.277 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.8 mt -131.82 148.55 52.56 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mt -140.58 120.28 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 104.648 -2.352 . . . . 0.0 104.648 173.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 mt -124.15 147.13 48.2 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 -172.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.69 169.41 11.26 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 169.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.7 -18.82 56.5 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.18 -23.03 18.71 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 119.452 1.024 . . . . 0.0 110.865 178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.75 7.45 6.13 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.652 1.596 . . . . 0.0 112.435 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -68.01 130.09 41.91 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 119.355 1.578 . . . . 0.0 109.891 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 -67.58 94.49 0.42 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.719 1.207 . . . . 0.0 109.838 -178.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 58.3 mt -71.32 -47.75 54.71 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 170.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -147.01 152.44 38.6 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.384 0.674 . . . . 0.0 109.378 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.22 147.04 19.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 169.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 1.0 OUTLIER -145.41 147.89 32.72 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 169.76 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -136.73 147.23 46.61 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.816 1.646 . . . . 0.0 106.756 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -133.73 8.3 3.85 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.662 1.185 . . . . 0.0 110.929 -176.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -136.12 148.3 48.17 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 123.725 0.81 . . . . 0.0 111.298 -169.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.84 -9.01 49.01 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.893 1.677 . . . . 0.0 114.002 -172.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 p -62.86 -40.84 98.71 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.093 -1.004 . . . . 0.0 112.136 176.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -141.77 64.96 19.17 Favored Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 118.951 0.796 . . . . 0.0 110.863 -173.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -86.52 -1.32 8.32 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 122.817 2.345 . . . . 0.0 113.451 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.6 m -134.98 140.21 45.5 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.028 0.931 . . . . 0.0 109.676 -169.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -45.2 -51.06 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 126.353 1.861 . . . . 0.0 113.01 -169.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -59.05 -43.81 91.74 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.481 0.582 . . . . 0.0 111.201 -175.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.45 -33.59 62.96 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -61.38 -48.91 79.08 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.499 0.72 . . . . 0.0 110.15 174.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.36 -35.81 74.58 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.207 0.912 . . . . 0.0 111.488 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.78 -48.61 73.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -63.45 -38.0 89.45 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.011 0.524 . . . . 0.0 111.123 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.01 -41.63 97.4 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.758 1.623 . . . . 0.0 111.258 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.03 -38.93 79.45 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 121.576 -0.702 . . . . 0.0 110.12 176.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.6 -51.07 68.4 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.908 -0.568 . . . . 0.0 110.343 169.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.1 mm -53.55 -55.06 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 124.987 1.315 . . . . 0.0 108.001 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -59.41 -48.05 83.13 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 122.789 0.436 . . . . 0.0 110.898 -175.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -58.65 -45.96 88.2 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.732 -0.605 . . . . 0.0 111.225 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.6 mmtm -71.15 -6.1 36.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 117.596 -1.192 . . . . 0.0 113.167 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.7 p -125.11 -37.25 2.44 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 120.862 1.664 . . . . 0.0 113.479 -169.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 20.7 p-80 -70.17 -0.35 7.67 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 120.321 1.419 . . . . 0.0 112.622 174.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -123.27 20.58 9.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.769 2.028 . . . . 0.0 110.009 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 98.3 m -138.26 160.06 40.43 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.083 1.353 . . . . 0.0 109.33 -169.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.21 85.51 4.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 124.537 1.135 . . . . 0.0 109.627 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.4 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 4.0 m -46.8 139.28 5.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.402 1.881 . . . . 0.0 115.779 -170.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 152.02 -37.49 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.321 1 C-N-CA 132.387 4.275 . . . . 0.0 107.521 170.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.0 tt -158.31 155.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 124.462 1.105 . . . . 0.0 109.306 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.0 173.88 13.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.47 1.908 . . . . 0.0 108.324 170.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 26.0 tp -139.29 115.6 10.46 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 105.089 -2.189 . . . . 0.0 105.089 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.3 pp -145.79 143.26 29.57 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.859 0.864 . . . . 0.0 109.848 -169.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 50.33 26.1 2.13 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.816 1.246 . . . . 0.0 112.721 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.68 9.98 82.18 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 125.054 1.312 . . . . 0.0 114.112 -177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.4 mt -123.81 130.88 53.32 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 126.093 1.757 . . . . 0.0 109.718 -172.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 19.2 m -74.49 142.19 44.85 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.88 132.61 34.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 175.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -101.61 149.84 6.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 33.5 p90 -154.67 163.83 39.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.575 0.702 . . . . 0.0 111.859 -179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -150.95 155.98 40.23 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.901 2.08 . . . . 0.0 106.184 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.3 m -140.06 143.94 36.59 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 68.4 m -145.16 128.58 16.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.795 0.838 . . . . 0.0 110.589 169.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 57.3 mt 57.59 -69.27 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 128.089 2.556 . . . . 0.0 114.783 168.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -146.09 19.84 1.41 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.208 2.203 . . . . 0.0 109.327 -171.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -138.73 147.01 42.18 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.471 1.508 . . . . 0.0 110.558 -168.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -132.97 141.35 48.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.694 1.598 . . . . 0.0 106.97 169.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -128.35 136.83 51.48 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 125.9 1.68 . . . . 0.0 107.038 -172.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -143.14 145.84 33.19 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.116 0.871 . . . . 0.0 110.478 -173.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.8 t -136.74 127.88 41.98 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.72 136.15 59.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 -169.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.45 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -157.87 -173.72 26.65 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 121.942 0.746 . . . . 0.0 112.394 178.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.8 m -67.84 171.22 6.85 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 113.824 -1.188 . . . . 0.0 110.041 178.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.3 m -130.21 28.52 4.99 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.465 1.106 . . . . 0.0 110.512 -171.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -59.24 -52.41 65.82 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.508 0.723 . . . . 0.0 112.324 -169.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -148.62 -12.87 0.34 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -153.28 164.96 37.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.788 1.176 . . . . 0.0 111.615 -169.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -128.23 -3.58 5.61 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 127.699 2.4 . . . . 0.0 110.243 174.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.43 -32.96 74.8 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 124.37 1.068 . . . . 0.0 110.976 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.6 ptt? -64.05 -33.66 76.25 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.901 0.773 . . . . 0.0 111.638 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.7 mt -71.25 -45.99 62.0 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 10.1 mmt -54.67 -41.18 69.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.288 0.635 . . . . 0.0 110.433 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.43 -51.05 67.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 118.794 0.724 . . . . 0.0 110.129 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 53.3 t -62.29 -44.27 98.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-O 118.89 -0.576 . . . . 0.0 110.004 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 63.2 tp -62.09 -45.31 94.09 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.875 0.762 . . . . 0.0 110.781 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -64.53 -44.93 89.29 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 4.5 t -59.51 -46.05 89.95 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.9 tp -62.66 -51.52 66.9 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 124.604 1.161 . . . . 0.0 111.861 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -64.61 -40.82 96.18 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 122.183 -0.323 . . . . 0.0 110.65 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -75.15 -38.37 60.98 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.344 -0.848 . . . . 0.0 111.534 -178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 21.9 p -63.99 -41.33 97.54 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 119.352 0.978 . . . . 0.0 110.686 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.8 mt -53.88 -51.02 64.99 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 169.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.6 m -54.83 -36.53 65.1 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 118.633 -0.698 . . . . 0.0 112.008 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.466 ' HB2' HG21 ' A' ' 143' ' ' VAL . 48.4 mm-40 -72.5 -51.34 20.47 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-N 119.516 1.053 . . . . 0.0 111.634 176.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 58.5 mtm -69.16 -41.02 77.83 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.035 0.834 . . . . 0.0 110.298 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.8 mp -74.16 -31.41 62.69 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.775 0.83 . . . . 0.0 110.27 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 42.77 45.93 4.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.466 1.907 . . . . 0.0 111.258 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.9 mmmt -145.9 -176.32 5.09 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 128.667 2.787 . . . . 0.0 106.868 -173.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.4 17.8 2.02 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.678 0.791 . . . . 0.0 111.396 -175.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.315 5.8 m 45.26 39.12 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 126.948 2.099 . . . . 0.0 111.949 -173.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -78.17 174.17 11.46 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.64 1.176 . . . . 0.0 110.897 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -50.66 67.73 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.066 0.946 . . . . 0.0 112.475 -169.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -65.63 -38.71 90.17 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.673 -0.679 . . . . 0.0 110.199 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.84 -39.76 92.94 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.9 0.773 . . . . 0.0 110.624 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.26 -46.08 78.29 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.737 0.699 . . . . 0.0 111.047 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 61.9 tp -58.15 -38.64 76.99 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.966 0.507 . . . . 0.0 110.946 -178.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -68.46 -16.97 64.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.251 1.02 . . . . 0.0 113.137 176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -132.52 22.51 4.34 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.295 0.952 . . . . 0.0 112.214 -169.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -45.0 -45.69 10.77 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.133 1.373 . . . . 0.0 111.905 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.34 -42.35 96.31 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.005 0.82 . . . . 0.0 111.371 -179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.33 -44.29 98.26 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 177.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.3 tp -57.46 -51.04 71.05 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.218 1.007 . . . . 0.0 110.709 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -56.21 -47.32 78.63 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.347 0.521 . . . . 0.0 109.773 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 92.8 mt -69.63 -30.78 68.58 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.043 -0.503 . . . . 0.0 111.781 -177.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.92 -46.4 78.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 119.131 0.878 . . . . 0.0 109.706 173.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 61.6 t -57.87 -40.65 77.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.449 0.568 . . . . 0.0 109.77 176.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -63.0 -8.35 7.11 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.28 1.432 . . . . 0.0 113.905 176.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -115.27 -31.67 5.9 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.686 1.195 . . . . 0.0 111.723 176.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 72.6 mt -66.27 -41.08 88.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 109.085 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.5 m -140.38 160.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 C-N-CA 124.327 1.051 . . . . 0.0 109.875 -173.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -148.6 127.57 12.73 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.197 1.399 . . . . 0.0 107.671 173.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.16 31.53 56.35 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.34 -0.7 . . . . 0.0 113.434 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.6 11.21 85.5 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.2 1.0 . . . . 0.0 113.823 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -117.61 137.27 52.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.8 pt -55.14 138.03 15.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.321 0.581 . . . . 0.0 110.33 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -126.11 -39.97 2.04 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.41 1.484 . . . . 0.0 108.838 -172.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -145.26 150.82 37.36 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.57 0.623 . . . . 0.0 109.386 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.4 m -135.05 24.63 3.58 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.902 1.281 . . . . 0.0 111.144 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -128.71 118.77 19.97 Favored Pre-proline 0 C--O 1.236 0.375 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.19 -42.57 2.86 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 121.743 1.629 . . . . 0.0 112.255 -169.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.3 pp0? -70.51 -26.06 63.42 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.555 1.07 . . . . 0.0 110.776 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -69.41 -45.08 70.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.652 1.115 . . . . 0.0 109.975 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 16.6 t -52.6 -48.91 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.466 HG21 ' HB2' ' A' ' 103' ' ' GLN . 79.6 t -60.9 -41.53 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-O 118.201 -0.905 . . . . 0.0 111.014 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -57.62 -46.9 83.54 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 119.618 1.099 . . . . 0.0 109.448 176.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -65.14 -40.3 94.24 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.638 -0.664 . . . . 0.0 111.466 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 96.6 t -63.81 -43.55 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 118.811 0.732 . . . . 0.0 109.555 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.93 -35.74 80.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.02 0.528 . . . . 0.0 111.086 -178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.0 mt -76.66 -28.39 55.97 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 124.706 1.202 . . . . 0.0 112.519 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 . . . . . 0 C--O 1.25 1.086 0 CA-C-N 118.921 0.782 . . . . 0.0 110.187 172.365 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -66.07 -7.84 19.83 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.47 -9.39 59.45 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.091 0.957 . . . . 0.0 112.473 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.8 tp -141.29 -31.53 0.58 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.365 1.066 . . . . 0.0 111.861 -171.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.1 mt -127.55 52.04 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.9 tp -57.05 -34.03 67.83 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.42 169.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -136.05 152.83 76.22 Favored Pre-proline 0 CA--C 1.54 0.592 0 C-N-CA 126.632 1.973 . . . . 0.0 106.168 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.61 4.26 3.15 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.082 3.188 . . . . 0.0 113.264 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.3 m -58.96 -20.15 49.74 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.865 1.666 . . . . 0.0 113.205 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.7 tp -64.04 109.35 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 173.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -56.94 139.34 52.12 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.403 1.081 . . . . 0.0 109.989 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.6 p -71.78 -42.5 67.06 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 81.4 t -123.07 118.59 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 -176.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -83.39 -33.99 25.65 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 117.984 -1.007 . . . . 0.0 110.13 175.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.89 167.27 24.97 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.412 1.005 . . . . 0.0 111.255 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -135.4 133.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.607 -2.368 . . . . 0.0 104.607 170.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.2 mt -132.98 146.77 52.07 Favored 'General case' 0 C--O 1.231 0.083 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.557 ' CG2' HD11 ' A' ' 75' ' ' LEU . 54.2 mt -136.67 116.31 16.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 103.098 -2.927 . . . . 0.0 103.098 169.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.79 147.9 47.14 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.593 0.711 . . . . 0.0 110.486 -169.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -66.35 171.64 4.67 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.882 169.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.18 21.18 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.857 2.063 . . . . 0.0 114.111 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -136.45 11.48 3.23 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.469 1.908 . . . . 0.0 110.602 172.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.98 35.51 71.95 Favored Glycine 0 CA--C 1.526 0.744 0 O-C-N 120.825 -1.172 . . . . 0.0 111.296 -176.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -104.23 132.53 50.38 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 118.421 1.111 . . . . 0.0 109.29 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 77.8 ttt-85 -58.87 114.88 2.76 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 123.834 0.854 . . . . 0.0 110.404 -174.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 8.5 mt -91.17 -42.66 10.32 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 156.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -145.47 149.03 33.92 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 169.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.12 144.25 12.8 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 168.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? -145.67 147.19 31.72 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 125.066 1.346 . . . . 0.0 107.689 169.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -132.19 150.44 52.15 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.834 1.654 . . . . 0.0 107.272 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -133.59 9.61 3.97 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.332 1.453 . . . . 0.0 110.597 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -129.2 150.18 50.69 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.283 1.433 . . . . 0.0 108.871 -169.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.16 -1.32 56.76 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.215 1.006 . . . . 0.0 112.98 -169.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 m -70.47 -34.32 72.26 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 118.683 0.674 . . . . 0.0 110.763 175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -140.56 67.23 30.05 Favored Pre-proline 0 CA--C 1.542 0.661 0 C-N-CA 124.058 0.943 . . . . 0.0 110.133 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -90.15 -2.71 5.42 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.705 2.27 . . . . 0.0 113.458 -174.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.4 m -135.45 145.75 47.52 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.003 0.921 . . . . 0.0 109.757 -169.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.5 t -45.54 -52.35 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 126.178 1.791 . . . . 0.0 113.036 -169.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -58.53 -45.5 88.72 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 118.755 0.707 . . . . 0.0 111.06 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.4 -35.06 65.8 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -177.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -61.12 -50.21 74.12 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.772 0.829 . . . . 0.0 110.047 174.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -60.14 -36.21 77.02 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.282 -0.886 . . . . 0.0 111.385 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.05 -47.64 76.63 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.09 0.556 . . . . 0.0 109.65 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -61.47 -37.66 84.43 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 119.11 -0.471 . . . . 0.0 110.432 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -65.2 -37.34 87.0 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.188 1.395 . . . . 0.0 112.042 176.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 9.4 mmpt? -63.92 -47.45 80.5 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.394 0.997 . . . . 0.0 109.236 172.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.31 -50.95 66.17 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 123.366 0.417 . . . . 0.0 110.551 175.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.0 mm -54.5 -55.66 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 125.408 1.483 . . . . 0.0 108.415 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -66.8 -43.79 82.97 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 117.995 0.361 . . . . 0.0 110.782 -172.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.93 -50.39 70.86 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.59 0.356 . . . . 0.0 110.31 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.1 mmtm -66.16 -50.18 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 122.278 0.231 . . . . 0.0 110.531 -176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 38.4 p -70.82 -35.67 72.59 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -168.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 11.9 p-80 -71.08 -1.42 12.2 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 120.359 1.436 . . . . 0.0 112.266 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -122.72 23.16 9.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.57 1.948 . . . . 0.0 109.726 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.2 m -132.94 160.01 38.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.977 1.711 . . . . 0.0 108.268 -177.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -80.99 28.88 0.35 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.754 1.621 . . . . 0.0 113.282 -169.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.454 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 3.9 m 67.69 -177.62 0.21 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.168 1.787 . . . . 0.0 113.725 176.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 10.6 pt-20 57.91 -46.01 0.05 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 131.522 3.929 . . . . 0.0 117.078 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.4 tt -152.88 154.64 7.44 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 120.461 1.482 . . . . 0.0 109.785 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.11 174.08 13.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.65 1.58 . . . . 0.0 109.01 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.37 105.73 6.38 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 103.78 -2.674 . . . . 0.0 103.78 178.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.8 mt -127.84 132.56 49.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -169.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 52.98 26.58 4.83 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.655 1.182 . . . . 0.0 112.515 176.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.44 1.74 77.67 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.815 1.198 . . . . 0.0 113.945 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -112.22 142.8 44.26 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 119.381 1.59 . . . . 0.0 110.622 -177.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.9 m -75.12 141.07 43.78 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 171.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.68 134.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 172.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.7 m -111.18 147.3 15.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.193 -1.781 . . . . 0.0 106.193 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 32.5 p90 -156.68 158.57 37.21 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.969 0.414 . . . . 0.0 111.677 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -147.3 175.22 10.94 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.125 0.97 . . . . 0.0 108.383 169.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 p -145.15 149.06 34.31 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 173.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.0 m -147.69 147.42 29.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.326 1.05 . . . . 0.0 109.274 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 mp 49.53 -87.65 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 126.937 2.095 . . . . 0.0 112.109 -174.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -145.26 26.0 1.35 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.849 2.06 . . . . 0.0 109.277 -176.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.557 HD11 ' CG2' ' A' ' 18' ' ' ILE . 62.3 tp -131.23 147.43 52.59 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 126.388 1.875 . . . . 0.0 109.347 -169.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -126.41 145.18 50.57 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -131.3 139.81 49.65 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.454 1.502 . . . . 0.0 107.422 -172.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -146.24 147.86 31.87 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 123.824 0.85 . . . . 0.0 111.029 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 93.5 t -135.68 127.82 46.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 169.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mm -114.63 135.83 53.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 -171.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.19 173.64 32.01 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.84 1.244 . . . . 0.0 112.019 -172.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.8 m -68.96 167.92 14.8 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.13 -1.535 . . . . 0.0 111.139 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.0 m -61.14 -46.97 88.39 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 170.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 10.3 t80 50.23 -167.11 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.048 2.139 . . . . 0.0 112.084 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -83.83 -14.91 50.11 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.589 -0.694 . . . . 0.0 111.405 171.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -161.19 163.13 31.37 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 124.89 1.276 . . . . 0.0 110.398 -172.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.09 -6.39 10.91 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.858 2.463 . . . . 0.0 110.452 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -61.17 -32.76 72.5 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 124.947 1.299 . . . . 0.0 110.571 177.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -64.06 -33.33 75.5 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 118.847 0.749 . . . . 0.0 111.601 173.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.4 mt -72.64 -44.24 62.17 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.6 mmt -54.33 -42.01 69.71 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.374 172.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.48 -48.49 77.43 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.542 0.737 . . . . 0.0 110.236 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.3 t -63.93 -44.67 98.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.018 0.527 . . . . 0.0 110.277 -178.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 47.3 tp -60.39 -51.84 67.76 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 118.618 0.645 . . . . 0.0 110.035 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -71.55 -31.83 67.45 Favored 'General case' 0 N--CA 1.457 -0.081 0 CA-C-O 118.584 -0.722 . . . . 0.0 110.989 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 46.4 t -60.76 -49.63 76.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 119.082 0.855 . . . . 0.0 109.659 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.8 tp -62.72 -46.12 89.57 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.739 0.699 . . . . 0.0 110.709 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.74 -43.57 98.6 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.013 0.525 . . . . 0.0 111.346 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -72.73 -36.61 67.8 Favored 'General case' 0 C--N 1.333 -0.113 0 O-C-N 121.432 -0.792 . . . . 0.0 110.886 -178.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.7 m -63.62 -44.15 94.77 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.765 0.711 . . . . 0.0 110.927 175.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.5 mt -52.26 -53.62 41.56 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.0 m -55.84 -40.42 72.83 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.412 0.445 . . . . 0.0 111.565 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -67.64 -43.75 79.58 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-O 118.479 -0.772 . . . . 0.0 111.999 -177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 12.5 ptt? -83.37 -29.05 28.52 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.59 1.086 . . . . 0.0 112.312 -177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.409 HD21 ' HB1' ' A' ' 113' ' ' ALA . 17.3 tp -88.79 -33.48 17.42 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.2 0.6 . . . . 0.0 112.24 -169.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 49.96 33.09 6.24 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.936 1.694 . . . . 0.0 114.132 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.7 pttt -153.1 -174.93 5.11 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 125.909 1.684 . . . . 0.0 106.908 169.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -48.19 125.77 9.87 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 19.8 m -78.01 45.13 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 124.616 1.166 . . . . 0.0 109.322 169.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -80.4 163.85 23.53 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.751 0.82 . . . . 0.0 109.994 176.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -59.11 -36.52 75.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -169.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.0 tpp85 -65.4 -42.02 93.03 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.013 0.824 . . . . 0.0 110.138 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.409 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -67.58 -33.41 74.95 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.478 0.581 . . . . 0.0 110.787 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.6 mp -65.5 -44.59 86.53 Favored 'General case' 0 N--CA 1.461 0.094 0 O-C-N 121.404 -0.81 . . . . 0.0 110.905 171.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.79 -38.38 72.43 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.435 0.694 . . . . 0.0 110.862 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.29 -21.99 65.66 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -129.24 27.27 5.37 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.466 1.03 . . . . 0.0 112.977 -175.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -40.88 -48.47 3.12 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 125.666 1.586 . . . . 0.0 112.922 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.7 -39.61 94.55 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.985 0.811 . . . . 0.0 111.304 -177.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.13 -43.56 92.99 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -58.22 -51.06 71.35 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.322 1.049 . . . . 0.0 110.298 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 -56.29 -46.03 79.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.332 0.653 . . . . 0.0 109.961 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.1 mt -65.85 -40.41 91.68 Favored 'General case' 0 N--CA 1.457 -0.101 0 CA-C-O 118.885 -0.579 . . . . 0.0 111.372 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -60.76 -46.45 90.39 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.93 0.786 . . . . 0.0 109.694 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.6 -46.47 86.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.302 0.501 . . . . 0.0 109.904 175.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -63.46 -21.83 66.53 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 112.936 179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -92.01 -28.72 17.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.895 0.878 . . . . 0.0 110.656 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.1 mt -80.06 -37.46 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 118.967 0.803 . . . . 0.0 109.525 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 20.6 t -140.14 143.67 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 124.308 1.043 . . . . 0.0 108.923 -171.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -145.69 134.55 22.45 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.584 1.154 . . . . 0.0 107.982 169.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.82 29.46 54.89 Favored Glycine 0 CA--C 1.533 1.156 0 CA-C-O 119.537 -0.591 . . . . 0.0 112.965 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.33 14.38 79.3 Favored Glycine 0 CA--C 1.529 0.915 0 CA-C-N 117.98 0.89 . . . . 0.0 113.949 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 26.6 t -120.04 135.54 60.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.214 -1.772 . . . . 0.0 106.214 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 24.1 pt -60.96 157.38 2.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-O 121.141 0.496 . . . . 0.0 110.411 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 96.5 mt -118.18 -48.48 2.53 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 124.272 1.029 . . . . 0.0 108.765 173.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -157.14 156.54 32.86 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.153 1.381 . . . . 0.0 107.563 177.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.4 p -140.44 17.26 2.38 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.986 0.914 . . . . 0.0 111.801 -174.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.66 114.96 63.09 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 169.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.38 -32.84 31.52 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.968 1.779 . . . . 0.0 113.025 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -64.15 -48.84 74.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.696 0.68 . . . . 0.0 109.183 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -66.22 -40.93 90.65 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.347 -0.846 . . . . 0.0 109.948 -175.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -56.75 -57.07 10.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 C-N-CA 123.866 0.866 . . . . 0.0 109.509 174.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.23 -39.63 86.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.406 0.548 . . . . 0.0 110.466 -172.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 -63.04 -44.05 96.97 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.637 0.653 . . . . 0.0 110.311 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 50.0 mtp85 -61.09 -46.24 91.45 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.512 -0.756 . . . . 0.0 110.672 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 34.2 m -72.68 -27.23 25.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 119.606 1.094 . . . . 0.0 111.881 -177.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.53 -38.83 74.28 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.858 0.753 . . . . 0.0 111.281 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 49.1 mt -71.01 -38.54 72.63 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 123.827 0.851 . . . . 0.0 110.944 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.246 176.43 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.4 ttt . . . . . 0 N--CA 1.483 1.19 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -152.91 -172.2 4.17 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.905 0.882 . . . . 0.0 110.564 -169.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 40.59 -92.4 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 128.732 2.813 . . . . 0.0 114.181 174.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -57.0 -31.6 65.26 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.218 1.007 . . . . 0.0 111.283 -177.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.5 mt -132.79 55.78 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 173.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -59.01 -32.41 69.69 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.714 0.806 . . . . 0.0 111.118 174.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -117.88 84.1 20.02 Favored Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 125.028 1.331 . . . . 0.0 108.717 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -73.49 12.51 0.85 Allowed 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 123.388 2.725 . . . . 0.0 112.396 172.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 m -57.85 -20.68 38.07 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.156 2.182 . . . . 0.0 113.831 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -65.7 -11.04 41.82 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.8 0.84 . . . . 0.0 113.152 172.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 74.94 123.87 0.04 OUTLIER 'General case' 0 C--O 1.235 0.328 0 C-N-CA 129.019 2.927 . . . . 0.0 109.314 -170.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.9 p -68.85 -36.01 77.62 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.7 m -135.52 142.8 38.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 169.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -98.76 -25.82 14.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 117.636 -1.174 . . . . 0.0 109.978 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.19 166.49 29.59 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.672 1.123 . . . . 0.0 112.059 174.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.95 133.06 50.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 N-CA-C 104.654 -2.35 . . . . 0.0 104.654 172.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.6 mt -135.09 149.96 50.15 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -178.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.8 mt -138.91 124.22 22.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 104.532 -2.395 . . . . 0.0 104.532 169.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.9 mt -121.47 147.95 45.08 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 -173.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.23 168.15 12.88 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.552 0.692 . . . . 0.0 109.727 169.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -55.11 -20.49 10.13 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.0 0.83 30.38 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 119.62 1.1 . . . . 0.0 111.494 178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.06 17.44 43.56 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.953 1.263 . . . . 0.0 112.771 175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.89 137.93 39.44 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 119.305 1.552 . . . . 0.0 109.878 173.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -60.33 120.62 10.21 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 175.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 34.2 mt -97.67 -44.53 6.73 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 163.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -145.23 151.3 38.18 Favored 'General case' 0 C--O 1.231 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.123 173.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.51 144.69 15.6 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 169.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -147.51 148.97 31.76 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 124.77 1.228 . . . . 0.0 107.856 171.877 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -136.88 148.1 46.87 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.779 1.631 . . . . 0.0 106.925 -173.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -133.89 2.55 3.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.973 0.909 . . . . 0.0 111.568 -174.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -132.9 159.2 40.59 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.011 0.925 . . . . 0.0 108.991 179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.87 5.57 3.16 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.274 2.23 . . . . 0.0 112.51 -174.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 p -61.62 -48.16 82.15 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.938 1.295 . . . . 0.0 110.58 177.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -143.9 73.69 16.6 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.533 1.133 . . . . 0.0 108.542 -177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -89.41 -0.69 6.02 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.654 2.236 . . . . 0.0 113.521 -171.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 m -135.04 139.78 45.08 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.061 0.944 . . . . 0.0 109.459 -169.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.2 t -43.58 -53.04 1.12 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.607 1.963 . . . . 0.0 113.043 -169.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -62.51 -43.54 98.55 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.387 0.539 . . . . 0.0 111.115 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -68.93 -35.66 77.05 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -63.78 -50.97 66.91 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.367 0.667 . . . . 0.0 110.558 176.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.62 -37.64 73.63 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.398 -0.814 . . . . 0.0 110.877 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.21 -45.56 80.34 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -61.99 -37.95 86.76 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.101 0.56 . . . . 0.0 110.897 176.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -63.99 -42.17 97.29 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.751 1.62 . . . . 0.0 111.181 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -66.01 -42.26 89.93 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 121.472 -0.768 . . . . 0.0 109.919 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.55 -46.77 77.07 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.068 0.547 . . . . 0.0 110.849 173.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.9 mm -56.5 -54.95 22.29 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 C-N-CA 124.673 1.189 . . . . 0.0 108.301 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 79.8 t80 -60.14 -48.8 80.22 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.188 0.449 . . . . 0.0 110.842 -177.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -58.91 -39.76 82.49 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.549 1.14 . . . . 0.0 112.126 -176.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -76.92 -47.49 20.87 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 123.135 0.574 . . . . 0.0 109.956 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.9 p -70.53 -26.81 63.74 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.454 -0.779 . . . . 0.0 112.403 -169.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -73.87 5.35 4.22 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 120.077 1.308 . . . . 0.0 112.428 175.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -123.08 14.09 9.79 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.309 1.844 . . . . 0.0 110.723 175.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.6 m -120.69 162.93 18.85 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.379 1.072 . . . . 0.0 109.318 -171.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -88.59 23.11 2.36 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.371 1.468 . . . . 0.0 112.992 -169.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.4 m 68.64 179.79 0.23 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.677 1.591 . . . . 0.0 113.848 175.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.31 10.5 pt-20 56.94 -50.95 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 131.275 3.83 . . . . 0.0 116.13 -175.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 16.0 tt -151.54 155.29 7.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 CA-C-N 120.377 1.444 . . . . 0.0 110.062 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -151.28 164.83 35.73 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 126.405 1.882 . . . . 0.0 109.23 -177.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.09 106.92 8.94 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 102.442 -3.17 . . . . 0.0 102.442 170.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.9 mp -81.01 -64.51 1.17 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -168.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -139.8 7.15 2.27 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.592 1.557 . . . . 0.0 110.844 -172.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 144.84 -38.82 1.25 Allowed Glycine 0 CA--C 1.526 0.775 0 C-N-CA 126.04 1.781 . . . . 0.0 109.383 -174.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -80.01 139.44 36.97 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.137 0.975 . . . . 0.0 110.463 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 62.1 m -85.22 141.19 30.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.931 1.292 . . . . 0.0 107.556 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 93.7 t -138.19 131.3 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 106.338 -1.726 . . . . 0.0 106.338 -176.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.6 m -107.91 145.29 15.28 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 169.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -156.86 159.19 37.95 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.93 0.395 . . . . 0.0 111.721 -176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -150.4 171.02 17.68 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.369 1.067 . . . . 0.0 108.562 170.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.1 m -143.71 140.89 30.24 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 m -146.77 142.07 27.37 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.541 0.737 . . . . 0.0 109.581 -179.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 53.79 -85.02 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 127.176 2.191 . . . . 0.0 112.328 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -146.6 29.57 1.02 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.269 1.827 . . . . 0.0 108.911 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.459 HD21 HD22 ' A' ' 114' ' ' LEU . 50.0 tp -137.43 147.24 45.23 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 126.257 1.823 . . . . 0.0 109.446 -169.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -129.55 139.26 51.56 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -127.19 140.48 52.21 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 125.624 1.57 . . . . 0.0 107.938 -172.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -146.31 149.17 33.31 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.161 0.984 . . . . 0.0 111.396 -173.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 86.0 t -140.6 140.76 33.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 169.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -130.82 134.99 61.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 -171.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.17 172.1 37.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-O 121.942 0.745 . . . . 0.0 113.065 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.4 m -63.08 129.27 39.61 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.207 1.403 . . . . 0.0 109.999 -173.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -77.01 33.45 0.15 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.204 1.802 . . . . 0.0 113.48 -172.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -67.08 169.57 8.25 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.21 1.004 . . . . 0.0 109.166 169.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.43 26.62 0.05 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.115 1.766 . . . . 0.0 113.484 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -138.09 46.78 2.04 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 125.785 1.634 . . . . 0.0 109.124 -178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -55.84 -14.97 2.7 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 121.439 -0.788 . . . . 0.0 111.603 169.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -51.12 -35.63 36.47 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 126.587 1.955 . . . . 0.0 111.213 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 6.1 ptt? -71.5 -32.77 68.6 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.566 1.076 . . . . 0.0 111.614 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.43 -48.2 73.56 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.21 -41.67 79.87 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 122.485 0.314 . . . . 0.0 110.341 178.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -47.26 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.737 0.815 . . . . 0.0 110.319 -178.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.3 t -61.99 -44.38 98.85 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.077 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.7 tp -60.91 -49.62 76.74 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.724 0.693 . . . . 0.0 110.493 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -63.34 -41.61 98.88 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 119.559 -0.258 . . . . 0.0 110.482 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.2 t -60.92 -49.98 75.26 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.193 0.597 . . . . 0.0 109.621 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.1 tp -63.14 -45.66 90.87 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-N 118.46 0.573 . . . . 0.0 110.895 -177.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -60.69 -47.92 84.09 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 -179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.58 -36.52 78.84 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.75 -0.594 . . . . 0.0 111.409 -177.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 61.2 m -59.04 -48.2 82.46 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 123.748 0.819 . . . . 0.0 110.631 175.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 36.2 mt -53.82 -50.71 65.57 Favored 'General case' 0 C--N 1.342 0.264 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 174.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.6 m -55.77 -37.91 69.18 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 118.04 -0.981 . . . . 0.0 112.677 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -70.81 -55.71 7.94 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.169 1.349 . . . . 0.0 110.141 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptt? -74.25 -29.85 61.87 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.821 -170.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.415 HD21 ' HB1' ' A' ' 113' ' ' ALA . 16.2 tp -88.71 -34.72 17.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.107 0.563 . . . . 0.0 111.388 -174.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.289 0.0 OUTLIER 41.04 48.82 2.96 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.887 1.675 . . . . 0.0 112.684 -173.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -136.83 179.63 6.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.043 2.137 . . . . 0.0 106.402 169.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -70.53 14.67 0.12 Allowed 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.278 25.3 m 44.49 40.92 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 127.122 2.169 . . . . 0.0 112.142 -173.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.15 165.72 24.51 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.391 0.677 . . . . 0.0 111.093 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -46.37 -51.61 14.52 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.429 1.892 . . . . 0.0 112.904 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -67.29 -41.38 85.5 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.139 0.427 . . . . 0.0 110.275 -178.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.415 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -64.45 -34.96 79.42 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.646 -0.659 . . . . 0.0 110.523 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.459 HD22 HD21 ' A' ' 75' ' ' LEU . 3.5 mp -64.87 -46.97 79.56 Favored 'General case' 0 CA--C 1.521 -0.172 0 O-C-N 121.269 -0.894 . . . . 0.0 110.895 172.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.7 tp -55.2 -37.16 66.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.404 0.682 . . . . 0.0 111.081 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -70.37 -18.81 63.06 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -132.43 25.14 4.46 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.649 1.113 . . . . 0.0 113.014 -174.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -41.21 -47.35 3.32 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.467 1.507 . . . . 0.0 112.419 177.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.92 -39.43 94.16 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.037 0.835 . . . . 0.0 111.903 -178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.06 -43.75 98.34 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.2 tp -57.95 -49.37 77.02 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.977 0.911 . . . . 0.0 110.684 173.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -55.83 -47.63 76.89 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.483 0.583 . . . . 0.0 109.61 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.2 mt -67.57 -35.91 79.92 Favored 'General case' 0 N--CA 1.457 -0.082 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.291 -176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.8 90.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.732 0.696 . . . . 0.0 109.85 175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.6 t -57.44 -43.84 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-N 118.801 0.728 . . . . 0.0 109.648 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.07 3.82 3.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.139 0.976 . . . . 0.0 113.611 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -120.34 -27.13 5.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.605 1.562 . . . . 0.0 110.988 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 79.8 mt -69.97 -39.7 77.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.255 0.934 . . . . 0.0 108.851 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.23 157.93 43.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.837 0.827 . . . . 0.0 110.738 -179.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -145.62 130.1 17.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.951 1.7 . . . . 0.0 106.744 169.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.65 32.42 53.95 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-O 119.323 -0.71 . . . . 0.0 113.377 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 70.59 19.82 76.72 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.377 1.088 . . . . 0.0 113.662 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 72.4 t -124.64 139.56 50.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 106.579 -1.638 . . . . 0.0 106.579 174.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 32.8 pt -55.18 135.83 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.346 0.593 . . . . 0.0 110.092 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -116.82 -42.24 2.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.714 1.606 . . . . 0.0 108.354 -173.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -147.86 152.1 37.05 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 169.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -131.5 -12.68 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 124.693 1.197 . . . . 0.0 111.428 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -76.76 117.04 62.07 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.337 0.971 . . . . 0.0 108.638 169.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.36 -31.68 27.66 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.24 1.96 . . . . 0.0 112.152 -172.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -44.38 85.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 121.614 -0.679 . . . . 0.0 109.319 177.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.89 -38.79 92.13 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.635 0.652 . . . . 0.0 110.544 177.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.6 t -56.71 -52.31 55.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 CA-C-N 118.86 0.754 . . . . 0.0 109.366 173.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.9 t -63.14 -38.53 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 118.966 0.803 . . . . 0.0 110.499 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.2 -39.75 93.79 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.153 0.888 . . . . 0.0 110.822 177.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -64.34 -46.01 85.33 Favored 'General case' 0 CA--C 1.526 0.034 0 CA-C-N 118.723 0.692 . . . . 0.0 110.543 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.96 -40.69 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 118.904 0.774 . . . . 0.0 109.618 177.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.04 -33.74 72.35 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.569 0.748 . . . . 0.0 112.1 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 30.9 mt -72.64 -32.7 66.1 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.062 0.945 . . . . 0.0 111.936 177.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 . . . . . 0 C--O 1.25 1.088 0 CA-C-N 118.336 0.517 . . . . 0.0 109.898 178.08 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.1 ttm . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.2 mp0 -62.25 152.43 33.48 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.287 1.035 . . . . 0.0 110.219 178.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.53 -14.37 60.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -177.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -157.95 167.95 28.5 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 127.35 2.26 . . . . 0.0 107.598 -177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.59 128.04 23.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 173.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 75.3 mt -140.19 157.12 46.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 126.008 1.723 . . . . 0.0 107.059 177.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 28.54 63.72 0.7 Allowed Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 127.751 2.42 . . . . 0.0 113.112 -176.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.5 166.7 24.8 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.704 2.936 . . . . 0.0 112.019 -173.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 m -122.43 26.39 8.4 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.268 1.427 . . . . 0.0 109.997 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tt -144.22 128.93 18.24 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 104.832 -2.285 . . . . 0.0 104.832 -177.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -57.12 133.95 55.45 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 123.807 0.843 . . . . 0.0 110.292 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.1 p -74.7 -34.81 62.7 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.9 t -132.03 139.98 49.01 Favored 'Isoleucine or valine' 0 C--O 1.231 0.116 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -175.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -106.85 -30.11 9.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 117.497 -1.239 . . . . 0.0 110.705 176.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.19 167.48 26.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.83 1.196 . . . . 0.0 111.847 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.5 mt -139.45 135.22 40.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 172.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 5.2 mt -138.15 154.6 49.17 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.483 HG22 HD11 ' A' ' 75' ' ' LEU . 39.7 mt -139.61 120.42 14.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.669 -2.715 . . . . 0.0 103.669 169.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.12 143.57 48.1 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.613 0.765 . . . . 0.0 109.459 -169.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -67.61 168.74 10.56 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 168.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.85 -14.71 61.96 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 124.1 0.96 . . . . 0.0 112.244 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -74.63 -9.52 58.65 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.139 0.975 . . . . 0.0 112.207 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.24 52.89 9.8 Favored Glycine 0 C--N 1.341 0.849 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 -172.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -136.92 131.44 33.07 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.633 1.173 . . . . 0.0 109.306 -173.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -59.66 107.23 0.57 Allowed 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.868 0.867 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.1 mt -73.83 -37.34 64.88 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 155.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -143.2 148.92 37.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 125.615 1.566 . . . . 0.0 107.851 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.89 141.89 10.19 Favored 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.4 OUTLIER -149.35 148.28 29.32 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 125.607 1.563 . . . . 0.0 107.714 176.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.43 152.24 46.9 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.711 1.604 . . . . 0.0 108.056 -173.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -136.12 -4.21 2.17 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.214 1.005 . . . . 0.0 112.581 -174.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -134.2 158.53 43.47 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.12 0.873 . . . . 0.0 110.037 -174.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.4 2.05 6.86 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.144 2.177 . . . . 0.0 112.747 -172.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 p -59.71 -48.44 81.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.65 1.18 . . . . 0.0 110.431 174.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -145.16 75.61 13.85 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.5 1.12 . . . . 0.0 108.704 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -90.36 -0.99 5.38 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.714 2.276 . . . . 0.0 113.695 -173.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.1 m -135.51 140.13 44.53 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 119.14 0.882 . . . . 0.0 109.943 -169.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.3 t -45.41 -50.4 3.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.532 1.933 . . . . 0.0 113.062 -169.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -57.9 -48.72 79.04 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 118.545 0.611 . . . . 0.0 110.927 -176.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.91 -35.13 72.15 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -63.29 -51.2 67.09 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.592 0.757 . . . . 0.0 110.924 177.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -62.01 -32.61 73.11 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.026 -1.046 . . . . 0.0 111.246 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.23 -48.88 71.77 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -61.3 -38.96 88.73 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.998 0.919 . . . . 0.0 111.513 178.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -61.0 -48.96 79.4 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 126.046 1.738 . . . . 0.0 110.59 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -68.76 -35.43 77.07 Favored 'General case' 0 N--CA 1.463 0.175 0 O-C-N 121.75 -0.594 . . . . 0.0 110.903 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -47.83 76.9 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.536 0.734 . . . . 0.0 110.553 169.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.4 mt -61.56 -47.34 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.1 0 C-N-CA 123.278 0.631 . . . . 0.0 109.703 179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -60.42 -47.09 87.59 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.631 0.65 . . . . 0.0 109.961 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -54.58 -48.02 72.61 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 124.059 0.943 . . . . 0.0 111.524 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.8 mmmt -69.97 -49.36 52.47 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.306 0.642 . . . . 0.0 110.016 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 39.2 p -70.3 -27.46 64.41 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.638 -0.664 . . . . 0.0 111.818 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -62.14 -17.96 59.46 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.895 0.77 . . . . 0.0 111.943 170.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -117.59 25.04 10.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.313 1.845 . . . . 0.0 110.036 -175.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.8 m -132.55 158.22 42.73 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.841 1.656 . . . . 0.0 107.608 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.82 -41.8 98.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 71.1 m 141.89 -174.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.752 1 C-N-CA 132.531 4.332 . . . . 0.0 108.633 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.335 10.1 pt-20 61.08 -47.57 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 131.366 3.866 . . . . 0.0 116.859 174.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.7 tt -151.61 152.54 10.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 120.198 1.363 . . . . 0.0 109.871 -175.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -147.79 165.18 31.33 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.404 1.882 . . . . 0.0 108.72 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -134.42 104.42 6.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 103.132 -2.914 . . . . 0.0 103.132 174.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -67.48 -63.09 1.13 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.773 0.321 . . . . 0.0 110.358 -169.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -149.34 1.75 0.54 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.394 2.278 . . . . 0.0 110.308 -174.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.39 -35.95 1.21 Allowed Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.03 1.776 . . . . 0.0 109.962 -171.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.0 mt -72.07 125.35 27.05 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 170.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.1 m -82.04 141.57 33.08 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 173.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.6 t -131.23 137.18 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -121.96 135.87 60.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 177.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -157.85 171.17 20.78 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.593 0.711 . . . . 0.0 112.072 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.9 tttp -153.94 157.08 38.64 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 126.026 1.73 . . . . 0.0 106.788 -177.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.1 m -137.71 133.07 33.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.2 m -152.98 144.03 23.03 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 123.152 0.581 . . . . 0.0 110.401 179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.4 mt 65.0 -84.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.403 1.881 . . . . 0.0 109.475 173.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -150.82 21.07 0.79 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.818 1.647 . . . . 0.0 109.52 174.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.483 HD11 HG22 ' A' ' 18' ' ' ILE . 21.9 tp -125.77 147.25 49.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 126.787 2.035 . . . . 0.0 110.144 -168.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -129.38 134.64 47.97 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 107.119 -1.437 . . . . 0.0 107.119 -177.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -123.75 138.62 54.48 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 125.148 1.379 . . . . 0.0 107.501 -169.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -144.8 150.3 36.93 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.643 1.11 . . . . 0.0 112.099 -170.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.0 t -137.26 140.7 41.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 127.441 2.296 . . . . 0.0 104.953 170.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -131.14 135.87 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.537 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 -177.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.47 175.74 30.97 Favored Glycine 0 N--CA 1.444 -0.832 0 CA-C-O 122.802 1.223 . . . . 0.0 112.502 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 39.9 m -61.21 154.17 24.16 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 112.599 -1.8 . . . . 0.0 110.639 -178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.4 m -57.01 -39.11 74.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.327 0.651 . . . . 0.0 109.881 171.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 5.9 t80 48.98 -143.59 0.48 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.689 1.996 . . . . 0.0 110.683 169.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.47 6.73 6.31 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.157 1.383 . . . . 0.0 111.625 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -159.19 163.19 36.21 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 125.489 1.516 . . . . 0.0 109.049 174.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -120.89 -6.87 9.56 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 127.436 2.294 . . . . 0.0 110.472 175.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.2 mt -57.17 -35.33 69.43 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 125.832 1.653 . . . . 0.0 110.655 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 23.1 ptt? -65.06 -34.16 77.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 118.582 0.628 . . . . 0.0 111.912 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.9 mt -73.51 -40.88 63.7 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.8 -45.57 70.8 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.154 0.982 . . . . 0.0 110.373 169.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.4 -48.41 75.5 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.257 1.023 . . . . 0.0 110.387 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.5 t -61.34 -44.56 98.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 C-N-CA 123.3 0.64 . . . . 0.0 110.006 -178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.4 tp -60.15 -48.99 79.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.2 0.455 . . . . 0.0 110.274 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -61.37 -44.82 96.51 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 119.47 -0.3 . . . . 0.0 110.4 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 94.6 m -62.5 -45.53 92.57 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 118.885 -0.579 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.6 tp -65.95 -46.19 79.04 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.195 0.907 . . . . 0.0 110.819 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -64.16 -41.99 96.92 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 117.981 0.355 . . . . 0.0 110.799 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -67.76 -39.55 84.14 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.571 -0.705 . . . . 0.0 110.801 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 60.1 m -59.8 -48.05 83.25 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.323 0.649 . . . . 0.0 110.734 176.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 51.4 mt -52.88 -48.86 66.83 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -60.24 -27.13 66.96 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.355 -0.831 . . . . 0.0 113.028 -178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.5 mm-40 -81.9 -53.33 6.25 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 120.12 1.327 . . . . 0.0 110.771 175.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -78.75 -33.79 46.27 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -168.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.56 -43.87 68.58 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.304 0.956 . . . . 0.0 109.104 174.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? 49.61 51.53 16.28 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.817 1.247 . . . . 0.0 110.048 -169.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -137.49 -171.37 2.96 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 127.762 2.425 . . . . 0.0 106.875 176.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -77.38 5.84 8.0 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.273 0.629 . . . . 0.0 112.113 175.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.324 4.8 m 49.2 40.34 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 126.91 2.084 . . . . 0.0 112.204 -174.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.27 168.83 18.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.128 0.971 . . . . 0.0 110.205 170.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -49.16 -48.23 45.1 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.605 1.162 . . . . 0.0 112.591 -176.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -66.4 -39.95 89.33 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 118.644 -0.694 . . . . 0.0 110.341 -178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.34 -36.88 85.17 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.201 0.91 . . . . 0.0 110.487 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.99 -47.06 78.89 Favored 'General case' 0 C--O 1.226 -0.144 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.769 172.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 60.3 tp -56.67 -38.06 71.71 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.69 0.677 . . . . 0.0 111.331 178.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.62 -19.08 64.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.03 0.932 . . . . 0.0 112.887 176.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -131.75 24.77 4.69 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.105 0.962 . . . . 0.0 111.561 -169.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -47.88 -47.66 31.7 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.917 1.287 . . . . 0.0 111.472 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -66.93 -36.34 82.02 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.241 0.473 . . . . 0.0 111.416 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.44 96.51 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 172.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.1 -49.07 79.09 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.685 1.194 . . . . 0.0 111.096 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -54.11 -48.42 70.76 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 118.983 0.811 . . . . 0.0 110.362 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 71.9 mt -68.43 -34.85 76.73 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.097 -0.478 . . . . 0.0 111.526 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.9 -44.94 83.79 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.925 0.784 . . . . 0.0 109.867 175.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.6 t -56.61 -45.29 82.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 174.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -65.8 -5.92 10.37 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.867 1.267 . . . . 0.0 113.686 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -112.3 -18.39 12.51 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 111.774 174.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 80.9 mt -81.4 -41.64 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.487 1.04 . . . . 0.0 108.467 172.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 3.9 p -145.0 148.11 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.267 1.027 . . . . 0.0 109.003 -169.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -146.89 136.44 22.93 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 171.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.8 29.58 50.41 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 119.341 -0.699 . . . . 0.0 112.928 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.68 14.86 81.69 Favored Glycine 0 CA--C 1.527 0.813 0 CA-C-N 118.171 0.986 . . . . 0.0 113.627 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.4 t -122.72 125.99 73.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.1 pt -57.93 145.72 8.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.3 pp -133.99 -13.33 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.022 0.929 . . . . 0.0 111.875 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -149.14 157.41 43.36 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 119.136 0.88 . . . . 0.0 108.964 169.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.7 p -143.93 31.06 1.28 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.809 1.643 . . . . 0.0 109.96 -176.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -134.63 114.04 12.09 Favored Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 125.08 1.352 . . . . 0.0 107.897 178.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.82 -31.49 10.22 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 122.308 2.005 . . . . 0.0 112.16 -170.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 17.3 tm0? -66.64 -45.38 79.21 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 -178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -71.98 -30.55 65.37 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 118.362 -0.827 . . . . 0.0 112.214 177.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.6 t -57.07 -54.62 27.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.612 1.096 . . . . 0.0 108.451 169.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.18 -36.18 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 119.159 0.89 . . . . 0.0 111.275 -178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.1 t-160 -55.77 -49.82 72.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.134 0.879 . . . . 0.0 109.989 174.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -63.01 -40.66 98.44 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.407 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 69.3 t -59.37 -43.54 90.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 119.778 1.172 . . . . 0.0 109.935 178.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.86 -36.7 75.72 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.307 0.643 . . . . 0.0 111.674 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.0 tt -68.23 -37.39 80.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 125.966 1.706 . . . . 0.0 111.622 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 . . . . . 0 C--O 1.249 1.047 0 C-N-CA 123.999 0.919 . . . . 0.0 109.817 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.1 ttm . . . . . 0 N--CA 1.484 1.229 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -152.26 163.31 39.69 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.072 1.349 . . . . 0.0 108.518 178.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.82 -1.49 1.26 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.331 1.053 . . . . 0.0 112.502 176.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.3 mt -148.18 164.65 33.29 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.932 2.093 . . . . 0.0 106.823 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.0 mt -63.11 114.78 1.83 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 169.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 81.1 mt -74.06 -19.93 60.45 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.18 0.592 . . . . 0.0 112.351 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -131.08 76.12 77.18 Favored Pre-proline 0 CA--C 1.539 0.523 0 C-N-CA 124.872 1.269 . . . . 0.0 107.771 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.74 -29.36 19.29 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.644 2.229 . . . . 0.0 111.98 -176.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.7 m 53.27 20.85 2.04 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.474 1.91 . . . . 0.0 114.539 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -152.92 172.38 16.87 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 126.287 1.835 . . . . 0.0 107.848 169.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -59.4 122.01 12.88 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 176.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 36.1 p -72.35 -31.65 65.81 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 173.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 m -136.44 139.81 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 C-N-CA 123.64 0.776 . . . . 0.0 109.159 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -91.94 -36.01 13.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 117.879 -1.058 . . . . 0.0 109.183 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.27 167.25 24.24 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.239 0.927 . . . . 0.0 112.541 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.7 mt -135.32 135.7 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 104.789 -2.301 . . . . 0.0 104.789 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.7 mt -133.92 151.93 51.67 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 53.5 mt -139.72 120.21 14.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 104.32 -2.474 . . . . 0.0 104.32 169.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 mt -123.76 144.5 49.65 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -172.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.76 168.41 9.61 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.401 170.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -71.68 10.46 0.66 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.665 1.186 . . . . 0.0 113.881 -174.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -127.99 5.17 5.94 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.64 1.576 . . . . 0.0 110.621 169.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.89 6.02 58.25 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 125.286 1.422 . . . . 0.0 113.203 172.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -69.83 132.42 46.01 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.426 1.613 . . . . 0.0 109.865 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -60.21 123.75 18.18 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.3 mt -100.11 -41.27 7.2 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 162.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -147.86 152.12 37.08 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 123.431 0.692 . . . . 0.0 109.6 172.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.08 146.63 18.99 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 169.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 tppt? -146.39 145.19 30.18 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 172.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -134.67 148.65 50.39 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 125.621 1.569 . . . . 0.0 106.855 -177.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -130.41 7.14 4.9 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.267 1.027 . . . . 0.0 110.684 -178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -133.66 147.38 51.42 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.081 0.952 . . . . 0.0 110.674 -170.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -68.61 -7.51 33.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.163 1.785 . . . . 0.0 114.483 -169.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.9 p -67.04 -35.29 79.57 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.646 1.112 . . . . 0.0 112.618 177.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -141.36 63.51 17.7 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 119.323 0.965 . . . . 0.0 111.231 -174.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -86.69 -1.39 8.21 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.98 2.454 . . . . 0.0 113.314 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 34.2 m -134.73 140.49 45.99 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 124.086 0.955 . . . . 0.0 109.511 -169.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.2 t -44.52 -52.63 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 126.338 1.855 . . . . 0.0 112.955 -169.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.87 -43.24 98.68 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.683 0.674 . . . . 0.0 111.193 -173.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -73.57 -33.97 64.91 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -60.4 -50.01 75.28 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-O 118.691 -0.671 . . . . 0.0 109.726 172.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -57.52 -37.2 72.64 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 119.176 0.898 . . . . 0.0 111.405 178.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.25 -50.13 72.96 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.313 0.645 . . . . 0.0 109.508 176.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.4 -37.48 87.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.847 0.459 . . . . 0.0 111.578 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -62.48 -45.74 91.64 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 126.131 1.772 . . . . 0.0 110.537 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -63.87 -42.94 97.39 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.903 -0.498 . . . . 0.0 109.993 175.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.0 -49.96 70.2 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.214 0.606 . . . . 0.0 110.888 173.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -58.05 -51.77 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.061 0 C-N-CA 123.974 0.91 . . . . 0.0 108.766 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -60.64 -47.91 84.12 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.371 0.532 . . . . 0.0 110.702 -174.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -56.65 -50.6 71.57 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 122.889 0.476 . . . . 0.0 110.855 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -64.83 -46.75 80.65 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.3 p -71.03 -32.62 69.42 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.669 -0.644 . . . . 0.0 111.822 -174.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -62.72 -12.73 25.71 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.368 -0.833 . . . . 0.0 111.701 170.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -122.34 25.02 9.12 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.063 1.745 . . . . 0.0 109.754 -175.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 99.2 m -133.06 161.64 33.84 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.834 1.653 . . . . 0.0 108.505 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -87.47 25.34 1.45 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.441 1.496 . . . . 0.0 113.426 -169.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.478 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 7.2 m 69.05 178.92 0.25 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.79 1.636 . . . . 0.0 113.728 176.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.6 pt-20 55.96 -46.56 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 131.107 3.763 . . . . 0.0 116.706 -174.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.8 tt -149.78 156.81 6.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 120.278 1.399 . . . . 0.0 109.62 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.87 158.29 43.88 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 126.479 1.912 . . . . 0.0 108.392 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -121.89 99.24 6.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 101.754 -3.424 . . . . 0.0 101.754 169.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 tp -65.41 -62.3 1.61 Allowed 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 123.64 0.776 . . . . 0.0 112.217 -168.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -149.44 4.96 0.61 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.582 1.953 . . . . 0.0 110.783 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 142.75 -35.39 1.71 Allowed Glycine 0 CA--C 1.528 0.852 0 C-N-CA 126.353 1.93 . . . . 0.0 108.817 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 57.2 mt -69.35 133.51 47.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 124.322 1.049 . . . . 0.0 108.418 169.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 34.3 m -90.2 144.11 26.16 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.6 t -136.54 137.89 47.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -177.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.3 m -119.92 146.18 25.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.478 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 25.7 p90 -157.74 160.27 37.7 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.091 0.472 . . . . 0.0 110.848 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -148.16 174.59 11.81 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.137 0.975 . . . . 0.0 108.63 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.7 p -140.57 145.46 36.77 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 171.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -146.79 142.29 27.58 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.69 0.796 . . . . 0.0 109.341 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.6 mp 53.03 -84.29 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.155 2.182 . . . . 0.0 111.454 -174.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -149.85 30.76 0.72 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.415 1.886 . . . . 0.0 109.06 -176.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.6 tp -137.83 148.18 45.22 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.203 1.401 . . . . 0.0 109.774 -169.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -124.9 146.55 49.27 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.926 0.891 . . . . 0.0 108.95 177.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -135.69 142.97 45.17 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.41 1.484 . . . . 0.0 107.96 -171.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -147.53 151.07 35.7 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.023 0.929 . . . . 0.0 111.258 -170.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -139.8 141.16 34.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 105.6 -2.0 . . . . 0.0 105.6 169.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.91 135.49 58.51 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.192 -1.781 . . . . 0.0 106.192 -173.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -167.71 -176.75 38.61 Favored Glycine 0 CA--C 1.522 0.479 0 CA-C-O 121.984 0.769 . . . . 0.0 113.532 -178.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.9 m -62.41 161.19 12.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.703 1.601 . . . . 0.0 111.605 -176.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.8 p -126.37 13.67 7.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.007 1.323 . . . . 0.0 111.966 -170.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 2.1 p90 -54.79 -50.4 68.58 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.772 1.629 . . . . 0.0 113.416 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -147.33 -23.3 0.39 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -172.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -151.64 155.35 38.2 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.097 0.862 . . . . 0.0 110.395 -170.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -124.12 -8.33 7.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.921 2.088 . . . . 0.0 110.68 175.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.415 HD12 ' H ' ' A' ' 88' ' ' LEU . 4.4 mp -58.2 -33.93 69.83 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.975 1.31 . . . . 0.0 110.935 177.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -65.66 -33.84 76.82 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 118.906 0.775 . . . . 0.0 111.459 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 36.9 mt -70.42 -46.49 63.83 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.1 mmt -55.54 -40.44 71.87 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.305 173.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.82 -49.76 71.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.847 0.859 . . . . 0.0 110.04 -178.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -61.61 -45.02 99.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 118.33 0.513 . . . . 0.0 110.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.97 -49.27 78.11 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.422 0.556 . . . . 0.0 110.312 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -63.52 -43.59 96.72 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.337 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 96.8 m -61.71 -45.32 94.46 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.656 -0.688 . . . . 0.0 110.225 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 46.4 tp -66.32 -45.89 78.77 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.45 1.023 . . . . 0.0 110.861 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -62.41 -43.33 99.07 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.429 0.633 . . . . 0.0 110.997 -179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -71.22 -37.33 72.05 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.346 -0.846 . . . . 0.0 110.947 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -60.53 -48.54 81.3 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.512 0.597 . . . . 0.0 110.587 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.4 mt -50.72 -51.23 51.9 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 173.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -55.0 -42.61 72.72 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 118.683 -0.675 . . . . 0.0 111.872 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.4 mm-40 -69.42 -48.72 60.12 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 119.577 1.08 . . . . 0.0 111.777 -178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 11.6 ptt? -73.6 -28.72 61.97 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.459 1.027 . . . . 0.0 112.003 -174.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 21.1 tp -85.4 -35.02 21.59 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -171.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 52.26 28.88 6.01 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.307 1.443 . . . . 0.0 113.765 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -153.59 -178.25 6.89 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.235 1.814 . . . . 0.0 106.89 169.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -48.07 131.89 15.71 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.895 0.878 . . . . 0.0 109.195 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 29.9 m -79.99 38.95 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 124.733 1.213 . . . . 0.0 110.22 172.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -78.2 171.39 15.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.613 1.165 . . . . 0.0 111.772 -176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -44.88 -61.21 1.69 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.079 1.752 . . . . 0.0 112.667 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -61.93 -41.43 97.94 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 121.949 -0.469 . . . . 0.0 110.337 -179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -71.31 -31.54 67.55 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.822 -0.549 . . . . 0.0 112.098 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -77.76 -32.99 52.93 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.09 -1.006 . . . . 0.0 109.96 173.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 9.7 tt -59.53 -33.88 71.95 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.736 0.698 . . . . 0.0 110.923 169.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -71.15 -17.83 62.53 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.27 -0.894 . . . . 0.0 113.265 179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -129.98 28.44 5.06 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.453 1.024 . . . . 0.0 112.789 -177.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.76 -48.14 2.17 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.921 1.688 . . . . 0.0 112.722 174.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.94 -37.9 89.17 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.111 0.869 . . . . 0.0 111.725 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.96 -43.51 95.84 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 176.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.7 tp -58.25 -49.04 78.53 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.98 0.912 . . . . 0.0 110.879 173.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.08 -48.32 76.33 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.513 0.597 . . . . 0.0 109.396 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 63.7 mt -65.75 -37.08 85.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.177 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.44 95.73 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 118.916 0.78 . . . . 0.0 110.593 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 44.8 t -60.38 -45.62 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 118.906 0.775 . . . . 0.0 109.09 174.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -73.49 18.2 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.064 1.346 . . . . 0.0 112.991 176.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -135.54 -25.67 1.29 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.665 1.586 . . . . 0.0 110.757 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.6 mt -82.71 -29.09 8.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 124.356 1.062 . . . . 0.0 109.552 171.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 22.8 t -138.04 147.5 25.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 119.685 1.129 . . . . 0.0 108.638 -171.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -144.28 126.19 15.34 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 125.473 1.509 . . . . 0.0 107.366 169.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.9 32.29 59.09 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 119.431 -0.649 . . . . 0.0 113.657 177.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.76 12.52 84.43 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.264 1.032 . . . . 0.0 113.672 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.9 t -121.13 141.26 42.39 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 176.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 30.3 pt -55.17 140.26 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-O 121.959 0.885 . . . . 0.0 110.049 174.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -113.66 -44.22 3.22 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 126.621 1.968 . . . . 0.0 107.512 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -145.74 161.84 38.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 175.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 42.0 m -148.19 38.69 0.89 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.193 0.997 . . . . 0.0 110.679 -177.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -132.95 117.44 14.94 Favored Pre-proline 0 C--O 1.235 0.335 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.65 -42.93 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.077 1.851 . . . . 0.0 113.01 -169.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.257 1.9 pp0? -69.38 -27.53 65.39 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.938 -1.101 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.58 -43.53 69.24 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 119.628 1.103 . . . . 0.0 109.741 175.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 11.7 t -52.46 -49.91 41.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 170.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 46.6 t -63.2 -39.28 84.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.697 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -57.57 -51.1 70.86 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 119.515 1.052 . . . . 0.0 109.273 175.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -62.56 -40.67 97.59 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.313 -0.851 . . . . 0.0 111.636 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 39.3 t -61.67 -43.3 96.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-N 120.071 1.305 . . . . 0.0 109.632 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.22 79.16 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.211 0.604 . . . . 0.0 111.512 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 60.8 tp -69.31 -39.28 78.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.036 1.734 . . . . 0.0 111.974 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.139 1.376 . . . . 0.0 110.095 -176.178 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 120.588 0.232 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -69.3 164.2 23.37 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.863 -0.523 . . . . 0.0 110.005 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.82 163.64 38.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.17 1.388 . . . . 0.0 108.873 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.45 -36.01 75.15 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.333 0.653 . . . . 0.0 111.31 178.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.3 mm -120.49 48.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 N-CA-C 106.652 -1.611 . . . . 0.0 106.652 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 59.7 tp -55.33 -35.67 65.41 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.551 -0.718 . . . . 0.0 110.34 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -138.21 146.76 53.05 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 126.531 1.932 . . . . 0.0 106.04 169.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -69.54 155.07 67.67 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.363 2.042 . . . . 0.0 110.922 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 m -78.59 14.22 1.36 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.83 1.252 . . . . 0.0 112.901 178.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -148.68 177.44 9.51 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.188 2.195 . . . . 0.0 107.212 -176.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -56.29 128.67 36.92 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 174.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.8 m -63.98 -34.8 78.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.055 0.942 . . . . 0.0 110.186 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.3 p -157.13 160.6 2.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 -174.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 mmtt -123.06 -40.0 2.45 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.947 1.299 . . . . 0.0 110.088 -175.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.97 168.8 23.84 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.432 0.56 . . . . 0.0 111.179 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.4 mt -137.4 137.1 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 N-CA-C 105.282 -2.118 . . . . 0.0 105.282 173.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -134.29 150.23 50.97 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.2 mt -137.19 120.09 20.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 169.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 68.7 mt -124.13 143.04 50.71 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -170.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.46 168.47 8.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.475 170.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -72.4 13.82 0.3 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.643 1.177 . . . . 0.0 113.794 -174.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -131.32 6.34 4.49 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.883 1.673 . . . . 0.0 110.327 169.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.87 5.96 59.55 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.397 1.475 . . . . 0.0 113.403 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -70.21 131.86 44.87 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 119.526 1.663 . . . . 0.0 109.918 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 20.4 ttm180 -60.64 118.79 7.01 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.1 mt -97.51 -41.54 8.13 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 108.596 -0.891 . . . . 0.0 108.596 165.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -146.5 152.53 39.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.14 146.86 20.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 169.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -142.16 139.23 32.03 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 171.606 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -127.56 147.84 50.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 174.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -129.23 8.84 5.59 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.125 0.57 . . . . 0.0 110.571 -177.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -141.05 152.25 44.69 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.431 0.692 . . . . 0.0 111.81 -169.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -66.68 -7.76 23.04 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.371 1.868 . . . . 0.0 113.962 -174.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.6 p -58.91 -42.73 90.33 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.149 -0.969 . . . . 0.0 112.157 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -145.16 72.26 14.6 Favored Pre-proline 0 CA--C 1.541 0.602 0 CA-C-N 119.079 0.854 . . . . 0.0 109.925 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -90.34 -1.17 5.39 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 122.811 2.341 . . . . 0.0 113.35 -174.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.3 m -132.44 137.09 47.15 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.205 1.002 . . . . 0.0 109.567 -169.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.4 t -46.87 -48.37 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 126.299 1.84 . . . . 0.0 112.683 -169.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -57.5 -48.0 80.41 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.417 0.553 . . . . 0.0 111.024 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -74.31 -33.35 63.17 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -177.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -61.34 -51.3 69.43 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.066 0.546 . . . . 0.0 110.714 174.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -61.49 -32.31 72.32 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.054 -1.029 . . . . 0.0 111.215 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.63 -48.43 72.26 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -61.34 -38.43 86.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.406 0.683 . . . . 0.0 111.195 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -63.33 -44.94 93.48 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.41 1.484 . . . . 0.0 111.15 178.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -62.85 -43.59 98.39 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.155 0.434 . . . . 0.0 109.84 175.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.29 -48.48 74.02 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.634 0.773 . . . . 0.0 110.946 173.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.3 mm -59.27 -53.37 49.08 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -60.17 -44.85 94.71 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.648 0.379 . . . . 0.0 110.624 -175.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -61.95 -47.61 84.11 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.278 0.631 . . . . 0.0 111.489 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -74.48 -48.66 25.95 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 122.787 0.435 . . . . 0.0 110.355 -170.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 p -59.18 -35.35 73.41 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.264 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.9 t-80 -54.16 -26.76 29.65 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -77.91 -16.94 57.83 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 119.05 0.841 . . . . 0.0 112.778 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.7 p -78.33 173.24 12.53 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.364 0.984 . . . . 0.0 111.4 -174.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.22 -5.22 48.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.303 1.041 . . . . 0.0 112.125 169.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 m 77.77 143.51 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.547 2.739 . . . . 0.0 113.762 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 127.29 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.699 1 C-N-CA 133.338 4.655 . . . . 0.0 108.703 172.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.0 tt -154.42 157.3 4.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 124.698 1.199 . . . . 0.0 109.002 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.04 166.73 27.81 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 127.693 2.397 . . . . 0.0 107.98 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.2 tp -130.05 112.24 13.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 106.357 -1.72 . . . . 0.0 106.357 174.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -84.23 -165.52 1.18 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.04 1.336 . . . . 0.0 108.962 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.89 19.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.339 2.256 . . . . 0.0 114.369 -173.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 150.96 -3.0 0.47 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.559 1.552 . . . . 0.0 112.621 -177.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.3 mt -126.32 131.98 51.72 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 118.353 1.076 . . . . 0.0 109.525 -170.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.0 m -75.68 141.61 42.69 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 84.5 t -137.97 117.94 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.204 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -98.2 146.23 8.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 169.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -155.66 162.72 40.54 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 117.989 0.359 . . . . 0.0 111.136 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -148.4 176.03 10.63 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.205 1.002 . . . . 0.0 108.636 170.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.6 p -141.26 148.6 40.09 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.2 m -144.7 141.87 29.63 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.0 mt 62.74 -78.84 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 126.879 2.072 . . . . 0.0 111.13 170.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -156.9 34.59 0.3 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.668 1.987 . . . . 0.0 108.931 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 60.5 tp -145.13 149.67 35.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.099 1.36 . . . . 0.0 109.784 -169.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -126.51 148.68 49.67 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.53 1.132 . . . . 0.0 109.231 178.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -137.34 140.55 41.55 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 125.378 1.471 . . . . 0.0 107.968 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -145.13 149.03 34.28 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 123.948 0.899 . . . . 0.0 110.501 -173.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 96.5 t -136.32 136.54 48.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 104.86 -2.274 . . . . 0.0 104.86 169.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -127.44 137.77 56.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 -170.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -158.24 -177.39 31.29 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-O 121.742 0.635 . . . . 0.0 112.11 -176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 m -58.76 158.12 8.53 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.136 1.374 . . . . 0.0 112.188 -174.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.7 p -74.46 38.5 0.12 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.458 1.903 . . . . 0.0 111.058 169.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -69.05 167.93 14.94 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.978 1.311 . . . . 0.0 111.029 -171.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.69 -10.25 50.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.455 1.102 . . . . 0.0 113.375 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -148.01 171.19 16.22 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.903 1.281 . . . . 0.0 108.889 169.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.53 3.63 3.89 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.233 2.213 . . . . 0.0 110.76 -170.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.1 mt -65.83 -31.68 72.78 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.472 1.109 . . . . 0.0 110.868 -173.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.96 -33.44 75.82 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.871 0.759 . . . . 0.0 111.332 173.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.2 mt -71.19 -44.7 64.92 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.2 mmt -56.03 -41.0 74.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.282 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.39 -47.04 80.74 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.472 0.709 . . . . 0.0 110.3 -178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.1 t -62.01 -45.66 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-O 118.696 -0.668 . . . . 0.0 109.943 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 58.8 tp -61.21 -47.73 84.76 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.874 0.761 . . . . 0.0 110.331 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -64.56 -43.63 93.31 Favored 'General case' 0 C--N 1.338 0.096 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.32 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 45.8 t -60.62 -50.61 72.85 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.268 0.627 . . . . 0.0 109.685 -179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.0 tp -61.97 -46.48 89.1 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.319 0.509 . . . . 0.0 110.992 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -64.67 -42.39 95.41 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 118.312 0.506 . . . . 0.0 111.046 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -67.73 -37.73 82.58 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 121.435 -0.791 . . . . 0.0 110.644 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 49.2 m -61.5 -46.73 88.77 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.664 0.785 . . . . 0.0 110.84 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.9 mt -54.72 -47.98 73.08 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.0 m -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.859 0.464 . . . . 0.0 111.879 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -73.12 -55.22 6.77 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 119.824 1.193 . . . . 0.0 109.69 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 67.0 mtm -66.03 -41.94 90.24 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.276 0.36 . . . . 0.0 111.751 -169.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.3 mp -68.95 -35.86 77.26 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 118.041 0.382 . . . . 0.0 110.601 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 52.94 27.87 6.0 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.849 1.259 . . . . 0.0 112.455 -174.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -155.61 -175.34 5.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 126.739 2.016 . . . . 0.0 107.99 174.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.29 125.88 22.61 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.978 0.911 . . . . 0.0 108.789 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.3 m -77.95 46.73 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 125.371 1.468 . . . . 0.0 110.857 178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.33 167.79 20.96 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.274 -0.891 . . . . 0.0 111.423 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -44.8 -54.17 6.64 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 126.104 1.762 . . . . 0.0 112.355 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -40.27 88.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.143 -0.348 . . . . 0.0 110.525 -176.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.5 -34.93 79.36 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.973 -0.455 . . . . 0.0 111.428 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.0 mp -67.87 -43.57 79.1 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 119.191 0.905 . . . . 0.0 110.46 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 69.7 tp -56.02 -37.26 68.95 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.28 0.491 . . . . 0.0 110.848 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -70.13 -18.81 63.24 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.279 1.032 . . . . 0.0 113.169 177.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -129.14 23.2 5.63 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.565 1.075 . . . . 0.0 111.442 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.65 -47.59 20.13 Favored 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.219 1.408 . . . . 0.0 111.832 -178.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -63.92 -39.73 94.85 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.941 0.791 . . . . 0.0 111.515 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.78 -43.6 95.97 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.332 -1.107 . . . . 0.0 110.332 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 tp -58.81 -50.44 73.95 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.287 1.035 . . . . 0.0 110.653 174.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -54.43 -49.03 70.94 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.481 0.712 . . . . 0.0 109.719 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 73.6 mt -67.47 -33.87 76.01 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 118.902 -0.571 . . . . 0.0 111.601 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.57 -46.94 80.59 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 118.859 0.754 . . . . 0.0 110.014 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 72.9 t -60.49 -41.04 86.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 118.658 0.663 . . . . 0.0 109.95 177.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -63.58 -24.83 67.96 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.402 0.681 . . . . 0.0 112.534 177.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -87.05 -34.73 19.08 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.576 -0.702 . . . . 0.0 110.683 177.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 75.5 mt -74.86 -39.22 45.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 118.171 -0.918 . . . . 0.0 109.765 -179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 23.9 t -137.66 148.18 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 120.274 1.397 . . . . 0.0 111.851 -169.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -150.66 133.02 15.52 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.847 1.659 . . . . 0.0 108.033 169.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.66 24.99 54.84 Favored Glycine 0 CA--C 1.535 1.319 0 CA-C-O 119.487 -0.618 . . . . 0.0 114.632 173.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.07 18.33 69.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 118.379 1.09 . . . . 0.0 112.856 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.92 141.67 44.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 N-CA-C 105.909 -1.886 . . . . 0.0 105.909 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 33.9 pt -70.55 154.96 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 119.684 -0.806 . . . . 0.0 109.859 176.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 68.6 mt -118.9 -19.28 8.61 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.029 1.331 . . . . 0.0 110.021 169.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -155.37 160.83 41.01 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 108.623 174.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -143.6 -5.98 0.81 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.558 1.143 . . . . 0.0 112.262 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -87.07 118.63 70.29 Favored Pre-proline 0 C--O 1.236 0.375 0 CA-C-N 119.735 1.152 . . . . 0.0 109.359 170.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -67.55 -30.94 34.7 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 121.902 1.735 . . . . 0.0 112.273 -174.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -64.64 -47.64 77.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -62.9 -38.69 91.94 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 118.392 0.542 . . . . 0.0 110.215 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 37.9 t -55.24 -58.49 4.27 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 174.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 30.1 m -67.0 -32.84 59.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.096 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.653 -173.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -61.13 -52.22 65.8 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 119.404 1.002 . . . . 0.0 109.987 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 80.0 mtt180 -61.52 -44.46 97.03 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 118.543 0.61 . . . . 0.0 110.091 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 15.2 t -58.45 -47.99 86.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 123.32 0.648 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.67 -29.92 56.55 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 122.681 0.392 . . . . 0.0 111.341 -171.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.27 -34.29 65.71 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.37 0.668 . . . . 0.0 111.108 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 76.1 mtm-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-N 118.375 0.534 . . . . 0.0 110.167 174.912 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.8 ttp . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -65.02 155.26 35.25 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.186 0.594 . . . . 0.0 110.195 176.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.63 146.86 52.94 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.239 0.616 . . . . 0.0 109.91 175.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 tt -64.15 -50.04 69.72 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 173.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 38.1 mm -84.99 69.49 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 106.465 -1.68 . . . . 0.0 106.465 169.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.5 tp -59.94 153.72 20.51 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 169.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -54.22 117.64 13.65 Favored Pre-proline 0 CA--C 1.543 0.711 0 C-N-CA 123.669 0.788 . . . . 0.0 108.943 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -79.4 151.81 23.09 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 122.11 1.873 . . . . 0.0 111.897 -169.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 p -75.02 -35.86 61.94 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.726 0.81 . . . . 0.0 109.126 169.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.4 tp -60.04 142.32 54.21 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.37 1.468 . . . . 0.0 109.426 170.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -56.16 130.29 43.63 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.566 1.147 . . . . 0.0 110.577 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.2 p -70.75 -32.09 69.13 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.408 0.683 . . . . 0.0 110.287 176.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.424 HG21 HG11 ' A' ' 129' ' ' VAL . 31.2 m -139.3 167.34 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 C-N-CA 124.315 1.046 . . . . 0.0 109.173 -179.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -131.25 -27.94 1.95 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 117.369 -1.301 . . . . 0.0 110.591 173.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.77 165.66 29.98 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 120.179 1.354 . . . . 0.0 112.123 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.9 mt -135.03 136.85 51.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 105.05 -2.204 . . . . 0.0 105.05 169.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.2 mt -133.57 149.75 51.64 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.5 mt -138.32 118.86 15.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 104.276 -2.49 . . . . 0.0 104.276 169.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 55.9 mt -122.71 144.92 48.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 -175.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.5 169.11 6.42 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.086 0.47 . . . . 0.0 110.519 169.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.78 -11.97 1.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.267 1.951 . . . . 0.0 116.267 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -116.0 3.49 13.64 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.049 1.34 . . . . 0.0 110.743 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.16 6.41 55.69 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.09 1.328 . . . . 0.0 112.85 171.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.79 128.08 35.38 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 119.564 1.682 . . . . 0.0 109.869 -179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -60.9 120.83 10.93 Favored 'General case' 0 C--O 1.232 0.146 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.5 mt -101.96 -41.73 6.36 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 166.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -145.81 151.99 38.8 Favored 'General case' 0 C--O 1.232 0.156 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 171.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.53 144.53 15.47 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 168.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -148.2 147.85 29.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 169.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -132.7 145.61 51.18 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -131.6 1.15 4.04 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.295 1.038 . . . . 0.0 111.493 -172.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -134.05 162.62 31.59 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.925 0.89 . . . . 0.0 108.914 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -71.78 4.2 3.48 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 126.495 1.918 . . . . 0.0 113.611 -169.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -62.24 -48.5 79.66 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.445 1.098 . . . . 0.0 111.275 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -143.94 74.99 16.1 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 124.162 0.985 . . . . 0.0 108.989 -176.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -88.23 -1.88 6.96 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 122.582 2.188 . . . . 0.0 113.568 -172.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.6 m -134.22 139.21 45.63 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.098 0.959 . . . . 0.0 109.238 -169.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -43.73 -52.85 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.431 1.893 . . . . 0.0 112.98 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.99 -42.11 98.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.464 0.575 . . . . 0.0 111.28 -174.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.27 -34.62 73.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -64.85 -49.81 69.08 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.289 0.635 . . . . 0.0 110.292 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -57.56 -35.69 70.66 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 121.449 -0.782 . . . . 0.0 111.033 177.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.44 -43.58 73.02 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 122.961 0.505 . . . . 0.0 109.932 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -62.43 -37.88 87.56 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 122.071 -0.393 . . . . 0.0 110.759 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -64.99 -43.12 93.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.72 1.608 . . . . 0.0 111.005 178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -59.27 -46.58 88.13 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.267 0.485 . . . . 0.0 109.86 172.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.53 -46.67 83.58 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.731 0.812 . . . . 0.0 111.1 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.3 mm -57.43 -53.52 42.97 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 C-N-CA 124.417 1.087 . . . . 0.0 108.344 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -60.46 -48.4 81.94 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.651 0.38 . . . . 0.0 110.366 -177.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -56.95 -43.67 81.78 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.031 0.932 . . . . 0.0 111.911 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -76.36 -48.9 18.32 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.053 0.541 . . . . 0.0 109.937 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.9 p -65.96 -30.23 70.76 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.672 -0.642 . . . . 0.0 112.048 -174.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -56.64 -24.42 48.09 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.486 -0.758 . . . . 0.0 111.782 172.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -110.64 21.41 16.6 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.31 1.444 . . . . 0.0 110.485 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 60.7 m -128.87 153.51 47.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.392 1.077 . . . . 0.0 109.322 -173.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -83.21 93.79 7.74 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 124.182 0.993 . . . . 0.0 109.048 176.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.4 m -45.4 140.85 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.468 1.907 . . . . 0.0 115.96 -171.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 144.73 -40.35 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 1 C-N-CA 133.223 4.609 . . . . 0.0 107.231 170.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -151.92 156.93 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 124.833 1.253 . . . . 0.0 109.041 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.5 171.75 17.61 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 127.398 2.279 . . . . 0.0 107.559 173.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.6 tt -142.23 117.7 10.27 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 105.86 -1.904 . . . . 0.0 105.86 169.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.9 mp -111.94 103.75 11.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 -169.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 61.34 -2.25 0.24 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.196 2.198 . . . . 0.0 115.324 170.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.8 -27.91 1.3 Allowed Glycine 0 CA--C 1.529 0.963 0 C-N-CA 126.021 1.772 . . . . 0.0 111.33 -178.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -85.77 132.64 34.09 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 118.314 1.057 . . . . 0.0 108.873 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.5 m -82.82 140.67 32.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 175.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 89.7 t -139.21 138.24 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -173.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.9 m -123.91 149.77 28.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 169.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -157.32 165.99 34.31 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.503 0.668 . . . . 0.0 111.876 -175.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -151.16 159.6 44.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 127.305 2.242 . . . . 0.0 106.641 -169.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -138.42 144.45 40.18 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 169.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.7 m -138.74 119.65 14.34 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.039 1.336 . . . . 0.0 108.432 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.3 mp 62.58 -76.35 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 C-N-CA 126.781 2.032 . . . . 0.0 113.061 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -143.39 21.84 1.86 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.607 1.563 . . . . 0.0 109.943 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.89 149.99 52.29 Favored 'General case' 0 N--CA 1.458 -0.075 0 C-N-CA 125.616 1.566 . . . . 0.0 109.387 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -130.4 142.18 50.52 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.983 1.313 . . . . 0.0 108.183 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -124.08 142.78 50.9 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.349 1.459 . . . . 0.0 107.087 -177.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -142.98 147.82 35.8 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.76 0.824 . . . . 0.0 109.251 -176.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.91 138.41 50.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.95 136.96 57.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 -172.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -152.07 -179.5 27.75 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-O 122.133 0.852 . . . . 0.0 112.192 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 14.4 m -59.62 165.89 2.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.696 1.599 . . . . 0.0 112.192 -177.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -67.66 6.6 0.62 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.919 1.688 . . . . 0.0 114.541 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -64.29 122.94 17.85 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -175.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.16 -18.69 63.74 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.081 1.352 . . . . 0.0 114.555 -169.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -66.2 -32.43 73.86 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.707 -1.139 . . . . 0.0 112.705 -170.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.282 2.0 pp20? 48.39 -10.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.23 3.012 . . . . 0.0 118.463 -176.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 33.2 mt -63.8 -32.22 73.65 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 120.441 -1.412 . . . . 0.0 111.18 -176.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.71 -33.96 77.08 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.185 0.902 . . . . 0.0 111.532 174.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.3 mt -68.65 -47.35 66.77 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 176.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 19.2 mmt -55.4 -41.59 72.92 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.458 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.1 -51.69 66.92 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.282 0.633 . . . . 0.0 109.503 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.45 -44.81 99.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 118.223 0.465 . . . . 0.0 110.34 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.3 tp -61.31 -49.28 77.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.329 0.513 . . . . 0.0 110.471 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -65.21 -40.59 94.36 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-O 118.892 -0.575 . . . . 0.0 110.412 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.6 m -61.68 -46.94 87.56 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.442 0.565 . . . . 0.0 110.091 178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.8 tp -63.26 -51.35 66.52 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 118.55 0.613 . . . . 0.0 110.033 -178.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -58.07 -47.18 83.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.215 0.606 . . . . 0.0 111.427 -177.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -79.9 -29.21 39.83 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 121.474 -0.766 . . . . 0.0 111.894 -173.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.2 t -68.62 -43.55 76.11 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 119.249 0.931 . . . . 0.0 110.085 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 37.2 mt -53.33 -49.81 66.3 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 169.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.0 m -60.13 -32.01 70.61 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.22 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 35.3 mm-40 -65.82 -62.26 1.6 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 120.013 1.278 . . . . 0.0 109.513 174.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.4 ptt? -72.65 -36.55 68.01 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -169.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.578 HD21 ' HB1' ' A' ' 113' ' ' ALA . 20.1 tp -73.88 -30.94 62.91 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 117.847 0.294 . . . . 0.0 111.352 -172.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 58.27 28.14 16.22 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.171 1.388 . . . . 0.0 113.08 172.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -150.15 176.56 10.73 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.935 2.094 . . . . 0.0 106.705 169.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -55.01 129.74 39.05 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.385 0.674 . . . . 0.0 109.719 169.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.419 HG12 HD23 ' A' ' 105' ' ' LEU . 24.5 m -81.5 48.06 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 125.24 1.416 . . . . 0.0 109.727 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -72.11 176.74 4.88 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 121.124 -0.985 . . . . 0.0 111.737 179.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -46.84 -57.87 4.48 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.364 1.866 . . . . 0.0 112.836 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -64.8 -37.42 87.54 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.368 0.531 . . . . 0.0 110.674 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.578 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -68.26 -32.61 72.91 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.409 0.284 . . . . 0.0 110.879 -177.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 1.5 mp -75.02 -38.54 61.49 Favored 'General case' 0 CA--C 1.514 -0.404 0 O-C-N 120.594 -1.316 . . . . 0.0 111.821 172.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.7 tp -55.96 -39.28 71.55 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.48 0.582 . . . . 0.0 110.62 174.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -75.87 -10.57 59.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -133.33 24.93 4.16 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.726 1.148 . . . . 0.0 113.246 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -43.97 -44.9 7.51 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.042 1.337 . . . . 0.0 112.233 177.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.73 -40.73 95.82 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.042 0.837 . . . . 0.0 111.776 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.48 -42.95 98.82 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.204 -1.158 . . . . 0.0 110.204 176.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -55.75 -49.02 74.23 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.112 0.965 . . . . 0.0 110.449 172.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -58.03 -45.84 86.28 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.622 0.646 . . . . 0.0 109.851 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.09 -37.45 85.81 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 119.118 -0.468 . . . . 0.0 111.356 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.38 90.42 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 119.016 0.825 . . . . 0.0 110.096 175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 47.1 t -57.97 -46.34 87.75 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.721 0.691 . . . . 0.0 109.746 176.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.7 -30.72 68.99 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.959 0.904 . . . . 0.0 112.661 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -85.79 -29.8 23.52 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.746 -0.596 . . . . 0.0 111.323 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 68.5 mt -78.99 -41.62 23.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 118.237 -0.887 . . . . 0.0 110.307 -177.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . 0.424 HG11 HG21 ' A' ' 13' ' ' VAL . 0.9 OUTLIER -145.96 153.25 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 119.918 1.236 . . . . 0.0 110.836 -170.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -155.84 141.44 17.85 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.885 1.274 . . . . 0.0 108.799 169.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.61 25.08 54.85 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.423 -0.654 . . . . 0.0 114.125 173.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 86.35 8.81 77.24 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 118.077 0.939 . . . . 0.0 113.203 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 14.3 t -127.44 142.25 44.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 119.305 1.552 . . . . 0.0 106.953 -177.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -62.37 155.93 4.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-O 121.598 0.713 . . . . 0.0 110.33 171.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.6 mt -122.69 -23.41 5.12 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 125.919 1.688 . . . . 0.0 109.834 171.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -154.55 161.31 41.69 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.935 0.789 . . . . 0.0 109.315 173.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 9.1 p -144.74 34.17 1.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.406 1.482 . . . . 0.0 110.448 -174.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.68 120.84 6.7 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.908 0.883 . . . . 0.0 109.924 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -64.73 -33.36 54.57 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.188 2.592 . . . . 0.0 114.608 -169.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.292 2.5 pp0? -84.42 -27.38 27.63 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.09 0.859 . . . . 0.0 111.523 -176.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -68.74 -40.68 79.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 120.018 1.281 . . . . 0.0 108.755 168.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.3 t -55.09 -53.22 36.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-O 118.223 -0.894 . . . . 0.0 108.78 171.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.28 -37.12 79.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 119.966 1.257 . . . . 0.0 111.132 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.43 -48.44 81.74 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.584 0.629 . . . . 0.0 109.515 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -68.27 -34.74 76.73 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.853 0.751 . . . . 0.0 111.636 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 48.7 t -61.98 -43.81 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 119.182 0.901 . . . . 0.0 109.448 174.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.97 -32.12 73.14 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.506 0.594 . . . . 0.0 111.426 176.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 37.4 tp -73.16 -24.83 60.62 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.86 1.664 . . . . 0.0 112.293 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 81.7 mmt-85 . . . . . 0 C--O 1.25 1.123 0 CA-C-N 118.597 0.635 . . . . 0.0 110.257 172.728 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.682 0.277 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -62.16 -34.05 75.66 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.829 0.852 . . . . 0.0 111.289 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -146.46 152.39 38.94 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 126.411 1.884 . . . . 0.0 106.926 171.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -61.28 143.94 54.75 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.221 0.464 . . . . 0.0 110.559 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 21.0 mt 46.45 57.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 125.514 1.526 . . . . 0.0 109.114 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.08 -25.99 67.34 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.997 0.919 . . . . 0.0 112.561 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -123.56 78.85 55.15 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.01 171.04 18.73 Favored 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.508 2.806 . . . . 0.0 111.667 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.1 m -73.43 5.57 3.63 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.375 1.47 . . . . 0.0 114.045 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -147.95 174.8 11.53 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.203 1.401 . . . . 0.0 110.074 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -60.01 128.76 38.44 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 123.742 0.817 . . . . 0.0 110.669 -178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 32.4 p -71.34 -32.0 68.02 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 171.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 m -135.5 140.8 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -100.52 -25.25 14.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 117.513 -1.232 . . . . 0.0 109.787 171.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.1 167.77 23.72 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 119.768 1.167 . . . . 0.0 111.89 176.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mt -138.96 139.29 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 mt -138.25 154.4 49.07 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.3 mt -138.05 120.46 18.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 103.814 -2.662 . . . . 0.0 103.814 168.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.9 mt -125.99 145.46 50.28 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 -169.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.08 170.73 3.39 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.678 0.791 . . . . 0.0 110.905 170.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -63.48 2.33 0.44 Allowed 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -131.32 9.66 4.78 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.688 1.595 . . . . 0.0 110.738 175.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.09 19.97 48.22 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 118.645 -1.086 . . . . 0.0 113.095 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -78.34 132.68 37.52 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.778 1.789 . . . . 0.0 109.697 171.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 ttm180 -61.53 116.83 5.04 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.354 0.662 . . . . 0.0 109.673 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mt -85.53 -43.27 13.67 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 157.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -148.87 148.48 29.91 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 124.953 1.301 . . . . 0.0 108.188 -173.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -161.03 146.7 14.41 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 3.3 mmpt? -141.28 149.14 40.88 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 125.65 1.58 . . . . 0.0 107.733 172.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -139.68 144.55 37.64 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 125.614 1.566 . . . . 0.0 107.596 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -135.0 -1.96 2.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.316 1.047 . . . . 0.0 112.041 -170.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -134.4 160.04 39.2 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.47 0.708 . . . . 0.0 109.447 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -72.95 3.89 4.82 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.846 2.059 . . . . 0.0 112.871 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -61.03 -47.62 85.57 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.663 1.185 . . . . 0.0 110.819 177.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -144.07 75.08 15.84 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.312 1.045 . . . . 0.0 108.888 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -90.03 -1.01 5.61 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.726 2.284 . . . . 0.0 113.687 -173.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.7 m -134.34 137.87 44.49 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 124.017 0.927 . . . . 0.0 109.463 -169.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.7 t -46.09 -49.84 4.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.066 1.746 . . . . 0.0 112.866 -169.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -58.18 -47.68 82.67 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 118.559 0.618 . . . . 0.0 111.019 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -73.92 -32.47 63.54 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.148 0.431 . . . . 0.0 110.36 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -61.79 -51.15 69.45 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.089 0.555 . . . . 0.0 110.594 174.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -60.18 -35.55 75.62 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 121.354 -0.841 . . . . 0.0 110.85 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.53 78.59 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.57 -38.54 87.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.327 0.651 . . . . 0.0 110.916 176.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.38 -42.75 99.66 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.465 1.506 . . . . 0.0 111.08 177.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -65.49 -41.97 92.66 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 118.583 0.629 . . . . 0.0 109.985 174.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.531 HD21 HD12 ' A' ' 62' ' ' LEU . 0.4 OUTLIER -55.89 -46.16 78.4 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.052 0.541 . . . . 0.0 111.11 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 7.9 mm -60.56 -52.4 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.153 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -60.44 -46.01 91.6 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.742 0.701 . . . . 0.0 110.521 -177.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -55.66 -47.39 76.78 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.869 0.867 . . . . 0.0 111.628 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -67.69 -52.12 41.59 Favored 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 123.28 0.632 . . . . 0.0 110.227 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.401 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 36.2 p -70.7 -33.43 70.87 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.845 -0.534 . . . . 0.0 112.207 -169.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -64.71 -12.86 51.26 Favored 'General case' 0 CA--C 1.546 0.807 0 O-C-N 121.139 -0.976 . . . . 0.0 111.961 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -111.03 13.81 21.99 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.612 1.965 . . . . 0.0 111.361 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.8 m -120.33 159.48 24.96 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.556 1.142 . . . . 0.0 109.111 -176.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.24 31.84 0.45 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.675 1.59 . . . . 0.0 112.824 -169.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m 68.24 178.03 0.25 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.392 1.877 . . . . 0.0 113.603 177.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.316 11.1 pt-20 56.25 -44.05 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 131.415 3.886 . . . . 0.0 117.138 -177.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -150.44 154.29 9.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 120.305 1.412 . . . . 0.0 109.259 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.15 163.8 36.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 126.839 2.056 . . . . 0.0 108.798 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -123.28 120.87 34.38 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.531 HD12 HD21 ' A' ' 47' ' ' ASN . 3.2 mm? -111.18 71.1 0.73 Allowed 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 126.167 1.787 . . . . 0.0 107.632 -172.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 62.84 7.95 2.85 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.533 1.533 . . . . 0.0 113.815 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 145.95 -33.91 1.47 Allowed Glycine 0 CA--C 1.532 1.114 0 C-N-CA 126.327 1.918 . . . . 0.0 110.42 -175.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.22 156.78 38.77 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.615 0.766 . . . . 0.0 109.141 170.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.2 m -117.06 138.77 51.39 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 106.309 -1.737 . . . . 0.0 106.309 175.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 77.8 t -136.33 139.31 45.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 -169.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.1 t -132.9 131.22 59.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 -174.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.401 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 21.5 p90 -156.81 164.61 37.89 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -168.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 pttp -154.68 179.04 9.44 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 123.496 0.719 . . . . 0.0 109.232 169.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 p -138.34 146.06 41.89 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 170.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.4 m -147.9 146.03 28.88 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 124.461 1.104 . . . . 0.0 109.592 -177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.4 mp 52.52 -83.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 127.03 2.132 . . . . 0.0 110.882 -172.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -152.81 29.43 0.52 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.82 2.048 . . . . 0.0 109.226 -176.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.2 tp -136.7 153.42 50.89 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.436 1.494 . . . . 0.0 110.27 -169.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -122.91 149.29 44.43 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.324 1.05 . . . . 0.0 109.125 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -136.89 141.56 42.75 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.587 1.555 . . . . 0.0 107.873 -172.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -145.18 150.24 36.39 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 124.074 0.95 . . . . 0.0 112.004 -169.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 46.4 t -137.19 138.74 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 104.738 -2.319 . . . . 0.0 104.738 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.4 mp -131.51 137.91 54.24 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 -179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.7 -179.7 36.54 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.505 1.058 . . . . 0.0 113.006 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -172.94 0.67 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.595 -1.803 . . . . 0.0 109.658 175.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.8 t -142.35 161.34 38.27 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 169.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -155.23 -50.1 0.09 Allowed 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.346 1.059 . . . . 0.0 109.285 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -150.4 -18.32 0.24 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.676 0.79 . . . . 0.0 111.828 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.456 HD22 ' C ' ' A' ' 86' ' ' ASN . 0.1 OUTLIER -155.48 171.74 19.41 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 123.823 0.849 . . . . 0.0 111.085 -175.208 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.61 -1.4 14.85 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.729 2.412 . . . . 0.0 110.518 171.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.35 -32.69 68.77 Favored 'General case' 0 CA--C 1.522 -0.128 0 C-N-CA 124.733 1.213 . . . . 0.0 111.697 -173.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -34.34 76.39 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.722 0.692 . . . . 0.0 111.274 177.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -69.45 -43.45 73.25 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 46.0 mmm -59.72 -40.11 86.91 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.348 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.09 -48.84 76.9 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.766 0.827 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.26 -43.18 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 118.583 -0.722 . . . . 0.0 110.185 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 tp -60.85 -48.51 81.47 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.112 0.869 . . . . 0.0 110.477 178.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -62.7 -46.4 88.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 119.341 -0.362 . . . . 0.0 110.317 -178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 89.7 m -60.61 -46.73 89.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 118.74 -0.648 . . . . 0.0 109.911 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.2 tp -61.01 -52.36 65.33 Favored 'General case' 0 N--CA 1.456 -0.131 0 CA-C-N 119.187 0.903 . . . . 0.0 111.024 -177.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -66.01 -40.62 91.26 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.065 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.12 -31.58 66.16 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.497 -0.752 . . . . 0.0 111.311 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 71.0 m -62.58 -49.84 73.66 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 123.614 0.765 . . . . 0.0 110.312 172.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 74.8 mt -53.07 -46.64 68.66 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.3 m -58.68 -41.12 85.46 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 118.552 -0.737 . . . . 0.0 112.104 178.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -67.39 -42.04 83.99 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 119.828 1.195 . . . . 0.0 111.419 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.0 ptp -76.75 -36.22 57.24 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.14 0.882 . . . . 0.0 111.622 -175.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.85 -33.95 24.74 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 118.663 0.665 . . . . 0.0 112.015 -173.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 50.15 29.9 3.92 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.591 1.156 . . . . 0.0 112.822 -176.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -154.84 -178.07 6.96 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 126.316 1.847 . . . . 0.0 107.486 169.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -53.78 121.17 7.35 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-O 121.511 0.672 . . . . 0.0 111.104 176.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.1 m -79.32 50.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.373 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.98 175.99 6.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.041 0.936 . . . . 0.0 111.974 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 52.9 tttm -46.88 -56.56 6.12 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.369 1.468 . . . . 0.0 112.279 176.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -62.37 -44.47 96.4 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.137 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.69 83.76 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.501 0.591 . . . . 0.0 110.329 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.25 -38.04 75.05 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 118.498 -0.763 . . . . 0.0 112.081 176.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 55.1 tp -58.24 -38.38 76.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.903 0.774 . . . . 0.0 110.831 176.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -72.04 -14.71 61.94 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -125.06 21.34 8.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.506 1.048 . . . . 0.0 111.923 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -48.37 -49.51 34.34 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.444 1.098 . . . . 0.0 112.215 -174.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.49 -36.49 81.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.617 0.644 . . . . 0.0 111.361 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.15 -43.88 98.5 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 173.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -61.2 -49.34 77.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.68 1.192 . . . . 0.0 110.845 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -53.17 -49.96 65.59 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 119.131 0.878 . . . . 0.0 110.068 175.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 65.0 mt -65.89 -41.38 91.62 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-O 119.179 -0.439 . . . . 0.0 111.037 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.52 -45.52 93.84 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.598 0.636 . . . . 0.0 110.294 178.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 26.9 t -57.81 -44.39 86.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 118.288 0.495 . . . . 0.0 109.702 175.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -66.77 -5.75 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.606 1.162 . . . . 0.0 113.63 179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -112.15 -28.81 7.82 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.017 1.327 . . . . 0.0 110.555 176.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 82.5 mt -66.97 -43.17 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.453 1.024 . . . . 0.0 108.723 171.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.3 m -138.45 155.19 28.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 C-N-CA 124.303 1.041 . . . . 0.0 109.856 -174.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -149.67 131.44 15.06 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.221 1.408 . . . . 0.0 107.814 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.22 30.78 55.65 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 119.28 -0.733 . . . . 0.0 113.201 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.59 12.56 84.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 118.268 1.034 . . . . 0.0 113.846 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 t -123.72 141.41 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.155 1.478 . . . . 0.0 107.038 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 31.0 pt -55.71 138.7 15.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.456 0.646 . . . . 0.0 110.174 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -122.1 -38.8 2.66 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.126 1.77 . . . . 0.0 108.564 -172.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -142.55 153.39 43.52 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 169.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.3 m -133.37 28.21 4.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.216 1.407 . . . . 0.0 110.305 -169.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -139.22 125.72 12.52 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.229 1.012 . . . . 0.0 108.71 176.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.23 -38.39 3.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.843 2.362 . . . . 0.0 113.71 -171.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.03 -28.11 57.58 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.032 -1.043 . . . . 0.0 110.433 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 68.0 mm-40 -61.8 -50.41 72.41 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.326 0.966 . . . . 0.0 109.748 169.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 12.3 t -51.98 -57.14 4.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 124.103 0.961 . . . . 0.0 109.02 177.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 54.5 t -63.56 -43.68 98.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.756 -173.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -57.36 -52.57 64.83 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 118.44 0.564 . . . . 0.0 109.643 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -57.32 -47.14 82.31 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.113 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 33.1 m -75.9 -28.47 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 CA-C-N 120.385 1.448 . . . . 0.0 112.031 -172.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.96 -35.31 62.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.526 0.603 . . . . 0.0 110.981 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 52.6 tp -67.9 -41.2 83.07 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.961 1.704 . . . . 0.0 111.27 176.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 . . . . . 0 C--O 1.249 1.066 0 C-N-CA 124.478 1.111 . . . . 0.0 110.03 -179.373 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.7 mtt . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -63.81 -32.67 74.26 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.217 0.607 . . . . 0.0 111.495 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.7 162.65 40.66 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.859 1.663 . . . . 0.0 108.165 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 59.8 tp -60.6 -33.17 72.34 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.182 0.593 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.2 mm -109.56 51.72 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 62.2 tp -53.95 -37.64 64.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.756 -0.59 . . . . 0.0 110.134 172.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.94 147.11 49.69 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 126.561 1.945 . . . . 0.0 106.069 169.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -74.29 166.65 29.01 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 122.603 2.202 . . . . 0.0 111.048 174.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.6 m -131.45 13.88 5.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.684 1.194 . . . . 0.0 111.479 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.431 HD23 ' H ' ' A' ' 11' ' ' TYR . 0.5 OUTLIER -151.4 165.64 33.49 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 126.611 1.964 . . . . 0.0 106.913 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.431 ' H ' HD23 ' A' ' 10' ' ' LEU . 74.8 m-85 -57.87 120.1 7.87 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 169.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 53.3 p -73.19 -23.14 60.37 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.886 -176.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.3 m -138.87 163.04 27.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 C-N-CA 123.906 0.882 . . . . 0.0 108.754 173.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.5 mttm -123.04 -28.12 4.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 117.247 -1.358 . . . . 0.0 110.166 171.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.82 165.31 30.47 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 120.094 1.315 . . . . 0.0 112.144 175.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.3 mt -133.23 133.8 57.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 170.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -131.19 146.46 52.34 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.5 mt -142.69 114.39 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 103.419 -2.808 . . . . 0.0 103.419 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.2 mt -124.89 148.1 48.48 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 123.419 0.688 . . . . 0.0 109.318 -169.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.79 170.55 13.38 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.915 169.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -60.26 -17.15 40.06 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -99.56 -14.31 19.08 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.647 1.112 . . . . 0.0 110.939 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 112.58 12.22 13.48 Favored Glycine 0 CA--C 1.528 0.876 0 C-N-CA 125.674 1.606 . . . . 0.0 112.239 175.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.93 132.04 47.14 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.158 1.479 . . . . 0.0 109.751 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 ttt180 -68.23 82.59 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 125.716 1.607 . . . . 0.0 109.853 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 97.2 mt -64.42 -47.95 77.22 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 171.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -148.99 150.68 33.25 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.682 0.793 . . . . 0.0 109.116 171.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.29 145.74 19.48 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 169.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -147.95 148.07 30.37 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 172.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -134.21 144.65 48.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -130.04 0.44 4.73 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.169 0.988 . . . . 0.0 111.514 -172.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -133.8 161.78 33.79 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.671 0.788 . . . . 0.0 109.244 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -72.68 4.9 3.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.476 1.91 . . . . 0.0 113.071 -169.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.8 p -62.67 -48.77 77.88 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.713 1.205 . . . . 0.0 110.954 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -143.24 73.36 17.88 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 124.311 1.045 . . . . 0.0 109.026 -176.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -88.28 -1.47 6.91 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.727 2.285 . . . . 0.0 113.582 -171.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.5 m -133.29 138.13 46.29 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.213 1.005 . . . . 0.0 109.012 -170.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 23.6 t -45.4 -50.59 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 126.133 1.773 . . . . 0.0 112.999 -169.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -60.28 -43.96 95.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.724 0.693 . . . . 0.0 111.07 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -71.53 -33.5 69.23 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.049 0.386 . . . . 0.0 110.104 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -62.32 -49.6 74.98 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.073 0.549 . . . . 0.0 110.047 174.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -58.37 -37.78 75.94 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.309 -0.869 . . . . 0.0 111.137 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.02 -47.38 77.65 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 122.978 0.511 . . . . 0.0 109.681 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -61.94 -37.53 85.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.117 0.567 . . . . 0.0 110.914 177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -63.74 -42.81 97.8 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.455 1.502 . . . . 0.0 111.059 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -62.61 -43.42 98.85 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.316 0.962 . . . . 0.0 109.812 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.496 HD21 HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -56.71 -48.76 77.01 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 122.979 0.512 . . . . 0.0 110.983 175.424 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.83 -51.99 63.46 Favored 'Isoleucine or valine' 0 C--O 1.231 0.111 0 C-N-CA 124.149 0.98 . . . . 0.0 108.969 178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -59.34 -47.16 86.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.185 0.594 . . . . 0.0 110.107 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -60.21 -48.17 82.86 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.541 0.736 . . . . 0.0 111.361 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -70.13 -43.07 71.72 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.423 0.689 . . . . 0.0 110.827 -174.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.8 p -67.5 -34.28 76.82 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.562 -0.712 . . . . 0.0 111.087 -176.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -65.51 -7.03 12.39 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.1 0.864 . . . . 0.0 112.853 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 65.0 mtt85 -119.11 25.02 10.45 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.689 1.996 . . . . 0.0 109.432 177.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.495 HG21 ' HB2' ' A' ' 60' ' ' ALA . 84.2 m -129.51 153.07 48.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.516 1.927 . . . . 0.0 107.211 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -61.99 -45.66 92.66 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.514 -173.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 68.5 m 145.81 -175.74 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 1 C-N-CA 132.458 4.303 . . . . 0.0 108.39 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.4 pt-20 57.76 -49.21 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 130.981 3.712 . . . . 0.0 116.413 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.1 tt -152.96 153.67 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 120.798 1.636 . . . . 0.0 110.484 -173.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.495 ' HB2' HG21 ' A' ' 55' ' ' THR . . . -145.5 159.93 42.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.227 1.411 . . . . 0.0 110.232 171.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -113.56 99.07 7.47 Favored 'General case' 0 CA--C 1.52 -0.204 1 N-CA-C 100.065 -4.05 . . . . 0.0 100.065 168.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.496 HD21 HD21 ' A' ' 47' ' ' ASN . 11.6 tp -65.32 -66.36 0.56 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.033 -168.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -146.22 6.97 1.01 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.332 1.853 . . . . 0.0 110.263 179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 141.27 -41.46 1.25 Allowed Glycine 0 CA--C 1.526 0.744 0 C-N-CA 126.361 1.934 . . . . 0.0 108.283 -169.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.9 mt -66.61 139.68 57.9 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 169.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 54.3 m -98.98 142.81 29.99 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 105.812 -1.922 . . . . 0.0 105.812 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.5 p -141.44 142.15 29.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 m -111.42 147.63 15.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 169.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -152.79 157.59 41.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.088 0.47 . . . . 0.0 110.73 174.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.443 ' HE2' ' CE2' ' A' ' 98' ' ' PHE . 18.1 ptmt -144.49 171.37 14.45 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 169.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.0 m -140.44 137.91 34.3 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 m -145.12 140.56 28.1 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.225 0.61 . . . . 0.0 109.864 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.9 mp 50.36 -85.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 127.358 2.263 . . . . 0.0 111.374 -169.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -142.61 16.27 1.99 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.471 1.908 . . . . 0.0 110.492 -176.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.1 145.99 44.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 126.846 2.058 . . . . 0.0 108.097 -169.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -127.24 138.08 53.02 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -134.13 139.15 45.71 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.61 1.164 . . . . 0.0 108.039 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -144.78 147.11 32.53 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.862 0.865 . . . . 0.0 110.059 -170.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 70.9 t -137.82 131.08 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 105.952 -1.87 . . . . 0.0 105.952 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -121.0 139.46 48.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 -172.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -157.39 179.23 33.3 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-O 122.58 1.1 . . . . 0.0 113.074 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.6 m -62.4 156.04 23.66 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.266 1.826 . . . . 0.0 112.73 -171.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.5 m -71.81 33.35 0.06 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 127.575 2.35 . . . . 0.0 112.325 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -70.96 179.0 2.9 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.846 1.658 . . . . 0.0 111.285 -172.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -63.96 -12.94 42.12 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.085 1.754 . . . . 0.0 113.333 -175.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -146.04 163.69 34.46 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.137 0.975 . . . . 0.0 110.172 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.08 -7.15 7.75 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.833 2.453 . . . . 0.0 110.298 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -56.99 -36.34 70.25 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.79 1.636 . . . . 0.0 110.368 177.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -64.78 -34.9 79.43 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.1 0.56 . . . . 0.0 112.161 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.0 mt -67.56 -47.71 69.03 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -42.68 67.69 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.201 1.0 . . . . 0.0 110.052 176.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.71 65.35 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.006 1.322 . . . . 0.0 110.212 -177.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.7 t -60.97 -44.04 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.136 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 65.9 tp -61.2 -48.04 83.38 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 118.506 0.593 . . . . 0.0 110.341 179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 -62.56 -44.45 96.31 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 119.126 -0.464 . . . . 0.0 110.406 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.6 m -61.47 -45.9 92.31 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.275 0.489 . . . . 0.0 110.473 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.71 -49.3 68.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 118.478 0.581 . . . . 0.0 109.968 -176.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.443 ' CE2' ' HE2' ' A' ' 70' ' ' LYS . 51.3 t80 -62.23 -42.22 99.12 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.899 0.381 . . . . 0.0 111.114 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -69.62 -37.27 76.78 Favored 'General case' 0 N--CA 1.456 -0.169 0 O-C-N 121.533 -0.73 . . . . 0.0 110.647 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.5 m -62.97 -44.79 95.07 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.731 0.696 . . . . 0.0 111.221 175.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.8 mt -52.55 -51.46 59.58 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.6 m -58.44 -40.41 82.5 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.602 0.564 . . . . 0.0 111.097 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -66.74 -44.34 81.76 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.59 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -81.54 -30.64 33.05 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.782 1.174 . . . . 0.0 112.179 -177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 35.2 mt -75.78 -44.66 40.38 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 119.154 0.888 . . . . 0.0 111.907 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 50.85 34.65 10.66 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.23 1.012 . . . . 0.0 111.973 -170.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -152.8 -176.92 5.95 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.784 1.633 . . . . 0.0 108.15 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -50.29 126.33 14.64 Favored 'General case' 0 CA--C 1.522 -0.112 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 173.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 35.1 m -76.04 44.7 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.399 1.48 . . . . 0.0 110.002 169.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.04 174.78 9.47 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.425 1.09 . . . . 0.0 110.805 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -52.08 -48.62 64.59 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.614 1.166 . . . . 0.0 112.304 -170.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 41.7 tpt85 -65.88 -35.92 81.98 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.907 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -73.0 -39.23 66.2 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.733 0.697 . . . . 0.0 111.107 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -58.03 -45.97 86.09 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 121.563 -0.711 . . . . 0.0 109.351 171.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 67.3 tp -61.34 -38.38 86.71 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.202 0.601 . . . . 0.0 111.793 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -65.29 -28.11 69.1 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.94 21.85 9.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.803 0.729 . . . . 0.0 112.531 -169.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -39.56 -50.77 2.22 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 125.564 1.546 . . . . 0.0 112.691 175.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -65.58 -39.24 91.4 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.076 0.853 . . . . 0.0 111.541 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.74 -43.17 99.35 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 175.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.9 tp -59.11 -49.42 77.94 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.123 0.969 . . . . 0.0 110.605 173.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -56.58 -46.87 80.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.758 0.708 . . . . 0.0 109.708 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -65.75 -40.05 91.69 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.084 -0.484 . . . . 0.0 110.749 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.98 96.6 Favored 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 118.981 0.81 . . . . 0.0 110.125 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.4 t -58.77 -46.11 90.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 118.923 -0.56 . . . . 0.0 109.727 175.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -63.42 -25.47 68.29 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -84.85 -40.03 17.6 Favored 'General case' 0 CA--C 1.53 0.173 0 O-C-N 121.626 -0.671 . . . . 0.0 111.228 173.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.37 -42.54 87.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 119.136 0.88 . . . . 0.0 109.799 -176.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -139.05 150.07 23.28 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.072 0 CA-C-N 119.245 0.929 . . . . 0.0 110.592 -174.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -149.97 132.96 16.17 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 125.059 1.344 . . . . 0.0 108.365 177.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.74 25.98 56.77 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.506 178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 79.56 14.27 81.47 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.299 1.049 . . . . 0.0 113.255 -178.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 20.2 t -126.73 141.43 46.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 119.257 1.529 . . . . 0.0 107.388 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.5 pt -57.31 138.67 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-O 121.658 0.742 . . . . 0.0 109.852 172.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -125.3 -36.63 2.47 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 126.321 1.849 . . . . 0.0 108.21 -172.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -140.19 156.63 46.43 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 169.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 50.3 m -151.21 39.34 0.67 Allowed 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.302 -0.874 . . . . 0.0 110.936 -174.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -140.71 120.19 8.55 Favored Pre-proline 0 C--O 1.234 0.284 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -70.93 -29.69 17.91 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.108 1.872 . . . . 0.0 111.622 -169.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -69.41 -42.65 74.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -66.61 -43.63 84.29 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 41.4 t -55.85 -55.14 19.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.473 176.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.9 p -63.96 -41.21 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 119.051 0.841 . . . . 0.0 110.556 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -64.01 -43.42 95.68 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.003 0.82 . . . . 0.0 110.235 179.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.07 -48.06 83.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 118.378 0.536 . . . . 0.0 110.307 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 19.9 m -73.68 -26.57 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 119.247 0.93 . . . . 0.0 111.387 -175.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.89 -34.9 74.16 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.739 0.699 . . . . 0.0 111.2 172.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.3 mp -75.83 -30.27 58.92 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.02 0.928 . . . . 0.0 111.947 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 84.1 mtt-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-N 118.535 0.607 . . . . 0.0 109.835 175.074 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.216 0 CA-C-O 120.936 0.398 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.11 171.03 17.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.176 1.39 . . . . 0.0 108.975 176.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.78 150.26 41.87 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.597 0.759 . . . . 0.0 110.283 175.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.15 -30.7 62.55 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.36 1.064 . . . . 0.0 111.825 178.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.6 pp -120.13 37.0 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 126.244 1.817 . . . . 0.0 110.758 -177.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -52.49 -39.94 61.8 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -139.0 139.19 22.69 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 127.069 2.148 . . . . 0.0 105.244 168.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.36 164.45 35.58 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 122.474 2.116 . . . . 0.0 110.96 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.8 m -68.41 -16.58 63.97 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.148 0.979 . . . . 0.0 113.63 -176.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -153.34 -178.78 7.2 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.227 1.411 . . . . 0.0 110.452 -175.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -38.16 129.73 1.26 Allowed 'General case' 0 C--O 1.236 0.366 0 C-N-CA 127.27 2.228 . . . . 0.0 112.639 177.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -72.38 -28.12 62.81 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.071 0.548 . . . . 0.0 110.688 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.49 164.01 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.335 1.054 . . . . 0.0 108.268 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.3 mttm -133.1 -31.75 1.25 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 117.589 -1.196 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.86 165.82 31.48 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 119.833 1.197 . . . . 0.0 111.352 179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 51.1 mt -138.08 135.63 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 105.211 -2.144 . . . . 0.0 105.211 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 12.8 mt -136.03 149.15 48.69 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 107.996 -1.112 . . . . 0.0 107.996 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 58.3 mt -138.75 125.27 24.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 169.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.9 mt -127.41 147.05 50.28 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 123.967 0.907 . . . . 0.0 108.964 -169.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -65.68 169.12 6.69 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -68.31 -15.13 63.45 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.626 1.17 . . . . 0.0 110.856 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -76.75 -7.2 54.93 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.062 -1.024 . . . . 0.0 112.06 171.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.18 51.16 29.14 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 109.144 -1.583 . . . . 0.0 109.144 -169.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -130.32 136.35 49.04 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.578 1.151 . . . . 0.0 109.067 -173.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -60.59 124.28 19.9 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.211 0.605 . . . . 0.0 110.147 -174.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.1 mt -102.48 -41.19 6.38 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 158.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -145.25 151.13 37.9 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.746 0.818 . . . . 0.0 109.413 172.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.99 144.48 13.16 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.913 0.885 . . . . 0.0 108.69 169.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -149.7 149.76 31.08 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.869 0.868 . . . . 0.0 108.854 169.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -135.21 144.27 46.85 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 126.093 1.757 . . . . 0.0 106.786 -174.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -132.85 -8.94 3.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.785 -170.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.33 20.98 7.34 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.248 0.931 . . . . 0.0 112.87 -169.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.2 t70 63.83 12.77 7.0 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.281 1.832 . . . . 0.0 113.602 169.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.1 p -62.84 -44.35 96.38 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.886 1.274 . . . . 0.0 110.555 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -141.0 83.69 13.77 Favored Pre-proline 0 CA--C 1.536 0.404 0 N-CA-C 106.409 -1.701 . . . . 0.0 106.409 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -92.5 0.03 3.95 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.667 2.244 . . . . 0.0 113.625 -170.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.0 m -136.24 139.39 42.7 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.195 0.998 . . . . 0.0 109.062 -169.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.7 t -43.83 -53.78 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 126.17 1.788 . . . . 0.0 112.845 -169.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -62.26 -44.21 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.572 0.624 . . . . 0.0 111.05 -173.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.38 -36.12 78.7 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -64.0 -50.35 68.87 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.235 0.614 . . . . 0.0 110.178 176.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -56.7 -37.33 70.77 Favored 'General case' 0 N--CA 1.463 0.193 0 O-C-N 121.47 -0.769 . . . . 0.0 110.954 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.58 -44.82 77.25 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 122.866 0.466 . . . . 0.0 109.966 179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -62.19 -36.95 83.46 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.4 -0.333 . . . . 0.0 110.645 175.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -65.18 -39.13 92.48 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.558 1.543 . . . . 0.0 111.231 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -64.5 -44.48 90.82 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 121.474 -0.766 . . . . 0.0 109.919 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.03 -48.15 76.51 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.083 -0.484 . . . . 0.0 110.571 174.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -55.11 -53.93 29.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 124.771 1.228 . . . . 0.0 108.714 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -64.82 -45.96 83.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.088 0.404 . . . . 0.0 110.588 -176.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.44 -44.62 92.9 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 121.938 -0.476 . . . . 0.0 111.315 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtm -64.83 -50.6 66.05 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.4 p -70.84 -30.08 66.4 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.427 -0.796 . . . . 0.0 112.495 -169.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.65 -14.23 60.79 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 119.73 1.15 . . . . 0.0 113.36 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.43 9.09 21.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.229 1.012 . . . . 0.0 112.321 177.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 97.2 m -111.62 157.6 20.23 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.431 1.092 . . . . 0.0 109.013 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -80.19 30.45 0.27 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.616 1.566 . . . . 0.0 112.971 -170.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.4 m 65.07 -176.8 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.338 1.855 . . . . 0.0 113.635 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.311 10.4 pt-20 56.57 -45.45 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 131.581 3.952 . . . . 0.0 116.84 -176.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 8.0 tt -154.07 152.49 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 120.626 1.557 . . . . 0.0 110.084 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.08 177.58 9.76 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.81 1.644 . . . . 0.0 108.422 171.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.5 tt -141.87 122.16 13.94 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 170.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.54 140.77 29.04 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 124.286 1.034 . . . . 0.0 109.878 -169.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 51.18 28.1 3.88 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.943 1.297 . . . . 0.0 112.215 -176.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.4 -3.27 87.23 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 125.205 1.383 . . . . 0.0 113.816 -178.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.7 mt -106.57 135.26 48.39 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 119.395 1.598 . . . . 0.0 109.226 -174.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 m -73.58 141.46 46.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.248 -1.389 . . . . 0.0 107.248 173.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.5 p -141.05 137.2 34.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.702 -0.624 . . . . 0.0 109.699 175.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -107.44 148.11 11.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 105.512 -2.032 . . . . 0.0 105.512 169.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 29.2 p90 -155.81 163.79 39.37 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.046 0.451 . . . . 0.0 111.377 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.86 175.89 11.23 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 170.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.3 p -140.67 142.14 34.95 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 m -146.16 141.38 27.43 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.832 0.853 . . . . 0.0 109.016 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.4 mp 54.43 -83.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 126.735 2.014 . . . . 0.0 110.829 -173.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -152.63 28.52 0.55 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.393 1.877 . . . . 0.0 109.482 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.406 HD23 ' CZ ' ' A' ' 77' ' ' PHE . 57.5 tp -132.85 147.37 52.3 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.967 1.707 . . . . 0.0 109.121 -169.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -125.34 141.27 52.17 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.406 ' CZ ' HD23 ' A' ' 75' ' ' LEU . 18.3 m-85 -134.49 143.54 47.53 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.865 1.266 . . . . 0.0 108.582 -170.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -147.2 145.61 29.55 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.185 0.994 . . . . 0.0 110.933 -169.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 94.0 t -135.81 129.49 48.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 N-CA-C 105.437 -2.06 . . . . 0.0 105.437 169.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.4 mp -122.04 138.07 53.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 -169.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.66 -175.33 24.86 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 122.287 0.937 . . . . 0.0 112.211 -177.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.3 m -59.8 159.01 9.47 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.362 1.465 . . . . 0.0 112.28 -173.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.81 25.85 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 127.483 2.313 . . . . 0.0 112.599 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -73.07 -179.67 3.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.954 1.302 . . . . 0.0 112.495 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -113.61 29.98 7.58 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.513 1.525 . . . . 0.0 113.066 -169.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.403 ' C ' ' H ' ' A' ' 88' ' ' LEU . 2.7 p30 -128.41 -39.51 1.67 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 116.563 -1.684 . . . . 0.0 113.592 169.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . 0.251 8.6 pm0 49.79 -16.73 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 128.36 2.664 . . . . 0.0 117.441 -173.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.403 ' H ' ' C ' ' A' ' 86' ' ' ASN . 35.5 mt -58.98 -34.23 71.59 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 127.213 2.205 . . . . 0.0 110.893 177.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 13.5 ptt? -65.57 -34.09 77.43 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.257 0.935 . . . . 0.0 111.738 175.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.0 mt -68.46 -46.88 68.6 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -53.18 -42.95 66.72 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.17 0.988 . . . . 0.0 109.958 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.33 -50.23 68.59 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.379 1.472 . . . . 0.0 110.265 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 50.5 t -60.67 -42.92 93.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 118.651 0.659 . . . . 0.0 110.168 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.76 -49.49 76.2 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.753 0.706 . . . . 0.0 110.488 178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.6 m-80 -61.06 -43.69 98.5 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-O 119.228 -0.415 . . . . 0.0 110.098 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 84.7 m -61.07 -46.1 92.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 118.394 -0.812 . . . . 0.0 110.529 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 tp -65.56 -46.4 79.64 Favored 'General case' 0 C--O 1.231 0.095 0 CA-C-N 119.756 1.162 . . . . 0.0 110.982 -176.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -64.06 -42.82 96.88 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.031 0.443 . . . . 0.0 110.771 -178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -68.57 -38.81 81.04 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.536 -0.728 . . . . 0.0 110.959 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.1 m -60.9 -48.96 79.43 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.261 0.624 . . . . 0.0 110.666 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.7 mt -50.92 -49.29 59.93 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 174.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.8 m -58.06 -39.85 79.5 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.437 -0.792 . . . . 0.0 111.844 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.2 mm-40 -68.23 -53.78 22.3 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.668 1.122 . . . . 0.0 111.032 178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 13.4 ptt? -70.63 -30.18 66.75 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.613 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.409 HD12 HG12 ' A' ' 109' ' ' VAL . 17.9 mt -75.99 -43.06 46.23 Favored 'General case' 0 C--N 1.339 0.127 0 CA-C-N 118.59 0.632 . . . . 0.0 112.171 174.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.9 tpp180 51.54 36.22 16.49 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.505 1.122 . . . . 0.0 110.793 -169.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -150.05 170.9 17.8 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 127.074 2.149 . . . . 0.0 107.045 170.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -57.55 132.68 53.92 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 123.262 0.625 . . . . 0.0 109.799 174.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.409 HG12 HD12 ' A' ' 105' ' ' LEU . 3.9 m -89.37 42.08 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 124.579 1.152 . . . . 0.0 111.115 -169.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.6 178.02 1.09 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.619 1.168 . . . . 0.0 112.113 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -46.41 -54.63 8.75 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.455 1.102 . . . . 0.0 111.778 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -63.27 -42.15 99.11 Favored 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.42 80.42 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 117.715 0.234 . . . . 0.0 111.614 -176.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.312 0.0 OUTLIER -79.55 -31.98 42.08 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 120.409 -1.432 . . . . 0.0 111.254 175.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.1 tp -59.99 -41.72 92.68 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.815 0.734 . . . . 0.0 111.269 170.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -74.48 -10.62 59.74 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.592 -0.693 . . . . 0.0 112.607 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.96 27.32 4.9 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.472 1.109 . . . . 0.0 112.878 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.1 mmt -43.17 -43.9 4.85 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.741 1.216 . . . . 0.0 112.723 175.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -63.81 -42.22 97.72 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.203 0.91 . . . . 0.0 111.211 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -64.79 -43.3 96.4 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.345 -1.102 . . . . 0.0 110.345 177.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.1 tp -55.61 -51.9 65.61 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.844 1.257 . . . . 0.0 110.219 174.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.9 m-30 -57.43 -47.32 82.1 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.013 0.525 . . . . 0.0 109.613 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 69.5 mt -65.0 -39.22 93.13 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.091 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.97 -44.33 89.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 118.843 0.747 . . . . 0.0 110.563 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 39.9 t -56.28 -48.24 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 174.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.53 6.8 0.98 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.52 1.528 . . . . 0.0 113.57 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -126.16 -23.28 3.91 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.743 1.617 . . . . 0.0 110.682 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 48.0 mt -84.35 -37.78 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 171.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.8 m -141.9 159.35 20.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 119.797 1.181 . . . . 0.0 111.239 -172.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -159.99 138.03 10.08 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.482 1.513 . . . . 0.0 108.366 169.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.59 26.53 57.3 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-O 119.434 -0.648 . . . . 0.0 114.464 171.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.49 13.77 75.28 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-N 118.215 1.007 . . . . 0.0 113.13 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 7.4 t -128.84 141.46 46.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 29.8 pt -64.16 158.95 3.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-O 121.734 0.778 . . . . 0.0 110.071 170.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 94.7 mt -116.98 -39.9 3.19 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 125.714 1.606 . . . . 0.0 108.769 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -155.68 160.97 40.81 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.624 1.169 . . . . 0.0 108.419 177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.5 p -138.03 37.88 2.35 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.658 1.583 . . . . 0.0 109.799 -173.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -136.1 120.13 12.75 Favored Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 174.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.48 -34.11 6.14 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 122.355 2.037 . . . . 0.0 112.149 -170.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -67.23 -45.66 76.1 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -177.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -65.73 -38.73 89.95 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.668 176.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 5.0 t -56.48 -53.58 38.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 119.141 0.882 . . . . 0.0 109.895 173.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 70.7 t -64.57 -36.49 77.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 119.725 1.148 . . . . 0.0 110.372 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.32 -50.81 72.29 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.989 0.813 . . . . 0.0 110.239 174.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.1 mtt-85 -59.54 -43.46 93.51 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.76 0.709 . . . . 0.0 111.102 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 51.1 t -59.0 -43.6 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-N 119.624 1.102 . . . . 0.0 110.048 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.2 -32.66 70.67 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.024 0.53 . . . . 0.0 111.691 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.9 tp -73.49 -28.65 62.04 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.268 1.827 . . . . 0.0 112.268 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 . . . . . 0 C--O 1.249 1.036 0 C-N-CA 123.735 0.814 . . . . 0.0 109.891 175.643 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -140.76 163.41 32.99 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.502 1.521 . . . . 0.0 107.715 176.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.39 140.18 58.85 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 123.207 0.603 . . . . 0.0 109.527 174.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.5 tp -75.38 -39.12 59.55 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 169.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.9 mt -79.87 62.49 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 106.281 -1.748 . . . . 0.0 106.281 169.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.8 tp -60.07 -27.06 66.66 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.967 0.907 . . . . 0.0 112.072 -172.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -132.54 108.43 13.28 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 171.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.88 153.37 68.47 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.408 2.072 . . . . 0.0 112.019 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.0 m -73.52 -5.12 38.12 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.804 1.241 . . . . 0.0 112.691 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -147.44 177.9 8.86 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.776 1.63 . . . . 0.0 109.778 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -37.7 126.44 1.15 Allowed 'General case' 0 C--O 1.235 0.293 0 C-N-CA 128.159 2.584 . . . . 0.0 115.09 -173.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 m -71.94 -38.75 69.76 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 168.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -141.78 135.26 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 C-N-CA 126.452 1.901 . . . . 0.0 106.555 175.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 47.7 mttm -92.55 -36.66 12.91 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.515 1.126 . . . . 0.0 110.736 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.67 167.29 28.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.996 0.816 . . . . 0.0 111.947 -175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.3 mt -135.33 135.4 52.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 104.893 -2.262 . . . . 0.0 104.893 171.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.6 mt -133.02 148.68 52.24 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.469 ' CG2' HD11 ' A' ' 75' ' ' LEU . 57.5 mt -136.78 113.18 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 102.763 -3.051 . . . . 0.0 102.763 169.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.2 mt -122.06 146.95 46.7 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 123.401 0.68 . . . . 0.0 109.678 -169.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -65.41 169.81 5.53 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 168.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -14.87 59.75 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 124.38 1.072 . . . . 0.0 112.413 173.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -75.22 -9.33 58.45 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.193 0.997 . . . . 0.0 112.139 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.83 51.47 15.09 Favored Glycine 0 C--N 1.339 0.737 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -140.06 133.45 29.97 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.259 1.023 . . . . 0.0 108.684 -176.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 124.84 22.0 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.279 0.491 . . . . 0.0 111.609 -170.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.8 mt -82.45 -37.42 25.44 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 153.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -145.55 151.97 38.98 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.055 1.342 . . . . 0.0 108.853 170.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -154.7 147.57 24.49 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 169.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -138.34 135.16 35.1 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 171.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -123.54 129.77 51.68 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -103.66 -24.51 13.36 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 169.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -55.07 158.46 2.87 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.086 2.554 . . . . 0.0 112.575 169.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -119.52 1.39 11.16 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.795 1.638 . . . . 0.0 111.867 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.8 m -75.81 -35.25 60.08 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.792 1.237 . . . . 0.0 110.084 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -130.15 67.91 80.37 Favored Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 125.287 1.435 . . . . 0.0 108.784 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -89.14 -1.38 6.21 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.814 2.343 . . . . 0.0 113.713 -173.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 m -137.63 148.92 46.2 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.894 0.878 . . . . 0.0 110.313 -169.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 36.7 t -45.54 -53.61 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 126.327 1.851 . . . . 0.0 112.733 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -54.61 -47.94 72.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 118.593 0.633 . . . . 0.0 111.064 -175.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -75.47 -34.16 60.88 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 -176.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -63.07 -46.81 85.7 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.815 0.846 . . . . 0.0 110.625 175.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -63.86 -34.24 77.49 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.281 0.946 . . . . 0.0 111.068 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.99 -47.22 78.33 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.903 -0.498 . . . . 0.0 109.897 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -61.6 -40.02 93.3 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.95 0.9 . . . . 0.0 110.805 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -57.41 -49.9 74.74 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.654 1.581 . . . . 0.0 111.168 172.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -62.4 -40.96 98.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.808 1.186 . . . . 0.0 110.53 179.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -48.46 77.96 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.028 0.531 . . . . 0.0 110.641 173.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 19.6 mt -60.85 -48.05 90.63 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.08 0 C-N-CA 123.712 0.805 . . . . 0.0 109.481 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -58.84 -45.91 88.94 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.484 0.714 . . . . 0.0 110.158 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -63.02 -42.13 99.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.857 0.463 . . . . 0.0 112.066 178.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.4 mmtt -68.86 -50.46 49.67 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.885 0.474 . . . . 0.0 110.471 -177.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.5 p -61.55 -35.15 76.96 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 123.733 0.813 . . . . 0.0 112.89 -169.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.45 0.3 3.11 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -119.93 33.48 5.6 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.307 1.443 . . . . 0.0 109.761 -171.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.4 p -135.97 -174.4 3.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.069 0.948 . . . . 0.0 111.116 -169.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -78.63 6.02 9.71 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.77 1.228 . . . . 0.0 111.814 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.1 m 68.79 31.25 4.51 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 126.264 1.826 . . . . 0.0 115.347 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -128.46 -16.69 4.31 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.917 0.487 . . . . 0.0 111.154 169.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.1 tt -164.74 156.28 1.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.361 1.064 . . . . 0.0 109.127 -171.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -146.82 171.81 14.62 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 126.351 1.861 . . . . 0.0 108.965 170.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -131.94 116.76 17.56 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 103.57 -2.752 . . . . 0.0 103.57 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 70.5 mt -78.15 -128.49 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.18 1.392 . . . . 0.0 108.535 -175.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -82.16 2.47 31.38 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.127 -0.983 . . . . 0.0 111.698 173.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 158.16 -33.29 0.51 Allowed Glycine 0 CA--C 1.529 0.93 0 C-N-CA 125.951 1.739 . . . . 0.0 110.474 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.0 mt -67.06 155.42 38.73 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 123.836 0.854 . . . . 0.0 109.423 173.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 55.8 m -112.45 145.2 40.6 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 -178.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.6 p -138.56 130.32 37.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.0 m -97.45 146.04 8.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 N-CA-C 105.913 -1.884 . . . . 0.0 105.913 169.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -156.49 167.14 31.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 118.124 0.42 . . . . 0.0 111.021 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -155.19 178.59 10.03 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.616 1.166 . . . . 0.0 108.103 169.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.1 p -142.42 148.59 38.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.91 0.484 . . . . 0.0 109.847 170.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.1 m -146.74 143.21 28.53 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.833 1.253 . . . . 0.0 108.936 -179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.2 mp 52.5 -87.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.507 1.923 . . . . 0.0 111.141 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -144.9 16.86 1.59 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.589 1.956 . . . . 0.0 109.76 -178.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.469 HD11 ' CG2' ' A' ' 18' ' ' ILE . 23.4 tp -120.22 144.07 47.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.971 2.108 . . . . 0.0 108.397 -169.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -122.55 146.02 47.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -135.51 137.47 42.14 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 -171.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -146.66 150.64 35.82 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.883 0.873 . . . . 0.0 110.529 -171.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 83.9 t -140.39 129.75 27.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 169.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.53 144.13 27.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 -173.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -162.2 -175.76 33.57 Favored Glycine 0 CA--C 1.523 0.557 0 CA-C-O 121.814 0.674 . . . . 0.0 112.203 174.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.7 m -61.88 155.31 23.7 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.192 1.397 . . . . 0.0 111.343 -175.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.6 m -56.23 -46.61 79.47 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.189 0.996 . . . . 0.0 110.677 178.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 15.0 t80 51.07 -169.83 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.204 2.202 . . . . 0.0 112.935 173.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -82.72 -18.29 41.34 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.356 -0.84 . . . . 0.0 111.405 175.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -157.49 176.94 12.0 Favored 'General case' 0 C--N 1.339 0.12 0 C-N-CA 125.478 1.511 . . . . 0.0 109.662 -175.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.79 4.18 8.13 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.119 2.167 . . . . 0.0 110.512 -174.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.8 mt -69.63 -32.4 71.08 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.558 1.143 . . . . 0.0 111.093 -173.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -34.16 77.53 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.248 0.931 . . . . 0.0 111.149 173.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.1 mt -66.76 -48.3 69.52 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 175.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 3.8 mmt -54.34 -42.85 70.71 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.029 0.531 . . . . 0.0 110.335 174.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.6 84.02 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.707 0.803 . . . . 0.0 110.502 -177.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.72 -43.67 96.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.062 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.9 tp -61.2 -49.15 78.32 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.131 0.878 . . . . 0.0 110.417 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -63.48 -42.91 98.55 Favored 'General case' 0 N--CA 1.461 0.093 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.306 -178.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.56 -51.89 67.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.66 -47.52 83.32 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.439 0.563 . . . . 0.0 110.26 -176.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -65.4 -40.16 93.06 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.976 0.353 . . . . 0.0 111.497 -177.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -71.72 -32.87 68.23 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 121.266 -0.896 . . . . 0.0 111.191 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -61.06 -49.89 75.5 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.685 0.794 . . . . 0.0 110.268 174.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 65.8 mt -52.44 -51.24 60.23 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 172.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.1 m -59.05 -19.68 46.32 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -84.78 -55.08 4.28 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 120.637 1.562 . . . . 0.0 110.44 171.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 23.0 ptt? -78.11 -7.44 57.0 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -171.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 30.0 tp -144.68 59.35 1.32 Allowed 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 127.291 2.236 . . . . 0.0 106.124 -171.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -52.55 -17.69 1.37 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.929 2.092 . . . . 0.0 114.929 -170.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -66.14 -166.15 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.45 1.023 . . . . 0.0 111.217 170.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -76.8 9.13 3.05 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 115.748 1.759 . . . . 0.0 115.748 -168.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.257 24.0 m 42.76 41.69 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 125.84 1.656 . . . . 0.0 112.914 -175.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -75.52 176.16 7.84 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.262 1.025 . . . . 0.0 111.184 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -49.85 -49.59 48.62 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.133 0.973 . . . . 0.0 112.972 -178.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -62.9 -40.37 97.36 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.037 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -62.41 -45.19 94.24 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.509 0.595 . . . . 0.0 110.305 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -59.78 -49.76 76.45 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.874 0.87 . . . . 0.0 110.107 175.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.33 -40.43 74.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.693 1.197 . . . . 0.0 110.98 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.87 -14.12 62.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.822 0.849 . . . . 0.0 113.086 178.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -133.72 22.38 3.93 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.919 0.887 . . . . 0.0 112.284 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.3 mmt -45.6 -45.37 13.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.301 1.44 . . . . 0.0 111.872 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.85 -40.29 94.92 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.433 1.015 . . . . 0.0 111.7 -177.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.0 -42.23 94.81 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 177.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 11.0 tp -57.09 -51.26 69.99 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.235 1.014 . . . . 0.0 110.493 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -55.5 -46.86 76.92 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.337 0.655 . . . . 0.0 109.286 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.57 -41.83 96.04 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.415 -0.802 . . . . 0.0 110.893 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -59.82 -45.35 92.66 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.613 1.097 . . . . 0.0 110.496 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 78.6 t -58.26 -42.71 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.616 0.644 . . . . 0.0 109.831 175.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -66.17 -26.34 67.37 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.376 0.67 . . . . 0.0 112.804 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -79.47 -34.67 41.23 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.163 0.892 . . . . 0.0 110.892 173.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 81.4 mt -79.56 -40.36 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-O 118.612 -0.709 . . . . 0.0 110.015 -174.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 16.6 t -133.9 145.56 33.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 119.302 0.955 . . . . 0.0 110.166 -169.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -146.16 131.92 19.0 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 125.415 1.486 . . . . 0.0 107.456 169.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 57.56 25.1 54.73 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 123.555 0.598 . . . . 0.0 113.705 179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.09 22.92 78.65 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-N 118.241 1.02 . . . . 0.0 113.387 -177.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 58.5 t -128.73 140.43 49.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 176.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 23.0 pt -69.08 159.36 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-O 121.377 0.608 . . . . 0.0 110.395 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 97.8 mt -121.71 -34.2 3.45 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.136 1.375 . . . . 0.0 109.512 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -156.09 158.18 37.29 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.743 1.217 . . . . 0.0 108.477 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 19.5 m -135.5 -3.81 2.35 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.664 1.585 . . . . 0.0 111.627 177.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -77.26 116.34 56.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 CA-C-N 119.316 0.962 . . . . 0.0 108.743 169.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -73.65 -33.91 6.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.563 2.176 . . . . 0.0 112.109 -171.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 19.3 tm0? -68.04 -44.41 76.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 -177.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -68.36 -34.57 76.31 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 118.823 -0.608 . . . . 0.0 111.171 176.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.6 t -57.76 -51.6 68.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 119.182 0.901 . . . . 0.0 109.587 170.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 63.8 t -63.19 -36.92 77.97 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.768 1.167 . . . . 0.0 110.613 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -46.84 87.95 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 119.197 0.908 . . . . 0.0 110.154 175.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 48.0 mtp180 -60.01 -44.51 94.54 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.089 175.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 78.1 t -58.48 -46.33 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 119.697 1.135 . . . . 0.0 109.707 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.53 -33.11 74.4 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.358 0.663 . . . . 0.0 111.663 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 64.7 tp -71.35 -31.42 67.32 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.93 1.692 . . . . 0.0 111.644 178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.214 -0.898 . . . . 0.0 109.947 175.651 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ptt? . . . . . 0 N--CA 1.484 1.261 0 CA-C-O 120.76 0.314 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -149.25 165.36 32.12 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.103 1.361 . . . . 0.0 107.988 175.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -153.23 0.5 0.25 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.199 1.4 . . . . 0.0 113.23 -178.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 61.6 tp -139.3 -37.99 0.5 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.528 1.131 . . . . 0.0 110.674 -172.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -120.34 53.56 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 18.6 mt -64.33 163.43 13.04 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 168.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -50.17 120.26 11.7 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.923 0.889 . . . . 0.0 109.361 179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.35 147.41 41.67 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.165 1.91 . . . . 0.0 111.931 -169.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m -136.79 39.82 2.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.568 1.947 . . . . 0.0 107.596 172.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.6 pp -144.14 -174.21 4.22 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.467 1.907 . . . . 0.0 109.947 -169.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -132.62 142.46 49.13 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.024 1.33 . . . . 0.0 108.003 -172.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.8 p -68.33 -31.08 70.24 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.428 0.558 . . . . 0.0 109.622 176.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 26.2 m -131.49 125.97 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 169.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.443 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 65.1 mttm -81.05 -32.18 34.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 117.986 -1.007 . . . . 0.0 109.091 171.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -159.56 168.15 26.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.961 0.8 . . . . 0.0 111.735 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 81.9 mt -136.65 138.02 46.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 104.303 -2.48 . . . . 0.0 104.303 170.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mt -137.0 151.0 48.47 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -138.19 120.2 18.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 103.343 -2.836 . . . . 0.0 103.343 169.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.7 mt -126.05 147.0 49.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.45 169.41 6.01 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.181 0.515 . . . . 0.0 110.845 171.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -9.66 0.65 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 116.572 2.064 . . . . 0.0 116.572 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -119.95 9.37 11.24 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.145 1.378 . . . . 0.0 110.586 178.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.24 19.6 54.83 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.635 1.112 . . . . 0.0 112.469 173.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -76.4 133.28 39.94 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.358 1.579 . . . . 0.0 109.671 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 tpp85 -55.89 126.02 23.9 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.111 0.965 . . . . 0.0 108.98 176.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.3 mt -116.81 -45.73 2.77 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 165.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -143.83 152.69 41.52 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.54 148.63 19.76 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -141.7 136.12 30.52 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.935 -1.876 . . . . 0.0 105.935 171.075 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -125.73 146.82 49.59 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -130.61 -34.11 1.58 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.914 0.886 . . . . 0.0 111.329 -176.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -78.93 159.59 27.65 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 172.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -78.53 7.79 6.19 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.935 1.694 . . . . 0.0 111.95 -178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 p -64.69 -45.99 84.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.244 1.418 . . . . 0.0 111.42 -177.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.9 70.88 29.5 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.338 1.055 . . . . 0.0 109.213 -174.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -86.26 -1.46 8.52 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.573 2.182 . . . . 0.0 113.538 -173.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 27.8 m -134.52 138.35 44.59 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.126 0.97 . . . . 0.0 109.684 -169.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.0 t -46.31 -49.05 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.299 1.839 . . . . 0.0 112.937 -169.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -57.15 -46.57 82.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.383 0.538 . . . . 0.0 110.816 -177.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -75.27 -32.07 60.93 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.286 -0.259 . . . . 0.0 110.349 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -62.72 -51.25 67.92 Favored 'General case' 0 N--CA 1.457 -0.092 0 C-N-CA 122.941 0.496 . . . . 0.0 110.203 175.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -59.64 -34.29 72.61 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 121.566 -0.708 . . . . 0.0 110.764 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.1 -47.28 74.72 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.745 0.418 . . . . 0.0 109.954 177.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -61.14 -36.63 80.29 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.829 0.451 . . . . 0.0 110.916 176.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -65.77 -40.94 92.51 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 125.17 1.388 . . . . 0.0 111.276 177.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -66.68 -39.24 88.04 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.245 0.93 . . . . 0.0 110.109 173.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.45 -48.74 76.43 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.992 0.517 . . . . 0.0 110.622 171.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -56.74 -54.6 27.23 Favored 'Isoleucine or valine' 0 C--O 1.231 0.109 0 C-N-CA 124.475 1.11 . . . . 0.0 108.513 179.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -58.72 -48.78 79.97 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.328 0.651 . . . . 0.0 110.208 -176.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -60.74 -45.13 95.48 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 123.319 0.648 . . . . 0.0 111.894 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 20.9 mmmt -70.02 -48.9 56.14 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 34.5 p -67.5 -28.18 67.62 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.591 -0.693 . . . . 0.0 112.088 -174.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -61.34 -18.76 60.19 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 118.796 0.725 . . . . 0.0 111.896 174.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 79.9 mtt-85 -113.76 19.22 16.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.751 1.62 . . . . 0.0 110.482 -172.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.3 m -131.49 154.44 48.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.759 1.224 . . . . 0.0 109.07 -169.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.79 88.73 4.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.31 1.044 . . . . 0.0 109.306 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.9 m -46.66 136.95 7.35 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 126.171 1.788 . . . . 0.0 115.808 -169.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.74 -38.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 1 C-N-CA 133.031 4.533 . . . . 0.0 107.75 172.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 tt -153.43 158.92 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.386 1.474 . . . . 0.0 108.569 178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -150.34 165.04 34.28 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.72 2.008 . . . . 0.0 108.778 173.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -131.21 104.32 6.99 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 102.16 -3.274 . . . . 0.0 102.16 170.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.5 mp -76.65 -64.87 1.02 Allowed 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -168.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -141.77 6.55 1.83 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.837 1.655 . . . . 0.0 110.617 -173.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 143.4 -39.13 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 126.442 1.972 . . . . 0.0 109.169 -173.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.6 mt -72.98 132.98 44.11 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.406 0.682 . . . . 0.0 109.869 174.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.2 m -83.41 142.91 30.65 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 78.8 t -135.67 138.13 48.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.15 133.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 104.897 -2.261 . . . . 0.0 104.897 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.6 p90 -156.73 164.31 38.27 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -169.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -152.33 177.47 10.54 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.698 1.199 . . . . 0.0 108.989 172.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.0 p -143.66 147.87 34.94 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.255 0.622 . . . . 0.0 109.38 170.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.0 m -146.97 137.99 23.92 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.483 1.113 . . . . 0.0 108.894 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 mp 53.16 -84.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 127.483 2.313 . . . . 0.0 112.551 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -143.92 23.29 1.73 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.795 1.638 . . . . 0.0 109.552 -176.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 30.1 tp -132.04 145.35 51.38 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 125.63 1.572 . . . . 0.0 109.152 -169.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -125.85 146.11 49.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 178.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -133.41 138.45 46.25 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 -171.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -144.3 148.81 35.29 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 123.568 0.747 . . . . 0.0 110.109 -173.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -134.44 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 104.432 -2.433 . . . . 0.0 104.432 170.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.27 134.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -173.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.443 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -156.98 177.08 34.05 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-O 122.398 0.999 . . . . 0.0 113.172 -177.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 7.3 m -63.68 164.36 9.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 112.867 -1.666 . . . . 0.0 109.5 174.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -128.09 28.23 5.56 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.943 0.897 . . . . 0.0 110.597 -169.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -60.37 -40.91 92.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.738 0.815 . . . . 0.0 112.968 -169.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -156.19 -23.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -145.9 165.77 27.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 119.339 0.972 . . . . 0.0 111.634 -171.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.8 -7.55 5.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.327 2.651 . . . . 0.0 110.326 177.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.66 -33.27 72.56 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 124.664 1.186 . . . . 0.0 110.775 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -64.09 -34.28 77.69 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 119.135 0.88 . . . . 0.0 111.819 174.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.8 mt -73.22 -42.02 63.11 Favored 'General case' 0 C--O 1.231 0.126 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.9 mmt -58.2 -40.75 82.37 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.521 171.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.06 -50.13 71.83 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.827 0.851 . . . . 0.0 109.815 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.3 t -62.42 -45.07 99.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 118.918 -0.563 . . . . 0.0 109.94 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 39.3 tp -60.47 -48.89 79.8 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.475 0.579 . . . . 0.0 110.304 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.46 -44.87 93.22 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 119.005 -0.521 . . . . 0.0 110.381 -178.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 87.7 m -62.78 -43.85 97.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.523 -178.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 41.9 tp -64.68 -51.73 60.93 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.785 0.72 . . . . 0.0 110.158 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -61.31 -42.04 97.99 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.396 0.278 . . . . 0.0 110.701 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -72.98 -38.56 66.62 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.593 -0.692 . . . . 0.0 111.483 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 m -61.51 -43.89 98.06 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.133 0.879 . . . . 0.0 110.379 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 mt -57.71 -45.76 85.31 Favored 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.2 m -61.4 -26.4 67.82 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.829 -0.605 . . . . 0.0 112.235 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -75.34 -53.13 9.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 119.819 1.19 . . . . 0.0 110.365 172.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 3.0 ptp -69.85 -39.42 76.39 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.012 0.824 . . . . 0.0 112.076 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.27 -37.82 60.76 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.532 0.606 . . . . 0.0 110.172 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 48.11 33.53 3.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.47 1.508 . . . . 0.0 113.028 -171.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -153.31 -172.21 4.16 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.92 2.088 . . . . 0.0 107.421 173.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -50.0 122.9 7.26 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.804 0.842 . . . . 0.0 109.322 173.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 34.6 m -78.03 40.64 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 C-N-CA 125.029 1.332 . . . . 0.0 110.251 170.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.19 172.56 12.64 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.673 1.189 . . . . 0.0 112.231 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -43.77 -60.23 1.89 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.981 2.112 . . . . 0.0 112.874 -177.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -63.11 -46.11 88.87 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.726 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -60.54 -37.71 82.08 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.943 0.792 . . . . 0.0 111.405 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.3 mp -74.14 -36.21 64.14 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.978 175.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 57.3 tp -58.63 -37.19 75.39 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.162 0.892 . . . . 0.0 110.956 171.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -73.9 -15.42 61.14 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 175.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -124.58 25.87 7.41 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.581 1.082 . . . . 0.0 111.454 -173.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.2 mmt -46.32 -48.63 18.25 Favored 'General case' 0 C--O 1.226 -0.168 0 C-N-CA 124.908 1.283 . . . . 0.0 112.007 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.98 -39.51 94.3 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.721 0.691 . . . . 0.0 111.343 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.9 -43.97 96.74 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.466 -1.054 . . . . 0.0 110.466 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.03 -50.6 72.88 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.609 1.163 . . . . 0.0 110.357 174.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -55.41 -48.07 74.93 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.028 0.531 . . . . 0.0 109.816 178.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.9 mt -65.56 -37.8 87.73 Favored 'General case' 0 CA--C 1.528 0.099 0 C-N-CA 123.17 0.588 . . . . 0.0 111.397 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.37 -47.08 83.58 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 118.872 0.76 . . . . 0.0 109.906 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.95 -46.21 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.3 -2.92 4.92 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.125 1.37 . . . . 0.0 113.804 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -117.16 -12.94 10.52 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.749 1.22 . . . . 0.0 112.005 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 59.8 mt -87.9 -40.39 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 119.278 0.945 . . . . 0.0 108.503 173.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.32 156.24 21.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 124.936 1.294 . . . . 0.0 109.901 -172.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -149.8 136.44 19.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.252 1.421 . . . . 0.0 107.217 169.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.97 29.07 50.62 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-O 119.242 -0.755 . . . . 0.0 113.182 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.08 10.67 85.28 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 118.299 1.049 . . . . 0.0 113.835 178.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 23.2 t -122.12 133.33 68.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-N 119.079 1.439 . . . . 0.0 107.265 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.1 pt -57.77 145.15 9.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.085 0.554 . . . . 0.0 110.393 173.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -133.81 -14.22 2.46 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.202 1.001 . . . . 0.0 112.018 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -149.86 159.88 44.02 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 169.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.9 m -150.69 41.81 0.78 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.874 1.27 . . . . 0.0 109.464 179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -139.94 119.86 9.05 Favored Pre-proline 0 C--O 1.235 0.325 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 173.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.02 -30.82 13.18 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.056 1.837 . . . . 0.0 112.114 -169.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.18 -41.47 85.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -68.27 -42.1 80.08 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 118.473 0.579 . . . . 0.0 109.685 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 28.6 t -55.96 -55.8 16.2 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.172 0 CA-C-O 118.845 -0.597 . . . . 0.0 109.471 176.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 5.2 p -65.26 -33.16 61.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 CA-C-N 119.604 1.093 . . . . 0.0 110.798 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -60.59 -44.32 96.38 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.177 0.899 . . . . 0.0 110.566 175.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -63.57 -42.65 98.3 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.469 -0.769 . . . . 0.0 110.935 175.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.1 t -58.18 -42.2 82.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-N 118.968 0.804 . . . . 0.0 109.745 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.51 -38.11 77.46 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.578 0.751 . . . . 0.0 111.902 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.6 mt -68.94 -39.22 79.68 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.479 0.711 . . . . 0.0 111.386 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 54.9 mtp180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.107 -0.949 . . . . 0.0 110.427 -176.487 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 tmt? . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -147.88 155.63 41.82 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 174.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -135.7 -11.49 2.06 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.059 1.344 . . . . 0.0 113.072 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -147.98 155.3 41.39 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 119.521 1.055 . . . . 0.0 109.512 170.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.4 mm 46.6 41.09 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.308 1.443 . . . . 0.0 109.76 -171.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 69.1 tp -58.99 -34.2 71.57 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.565 0.746 . . . . 0.0 109.53 171.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -136.82 157.46 74.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 127.209 2.203 . . . . 0.0 106.027 169.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.53 38.21 0.55 Allowed 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.215 3.277 . . . . 0.0 112.293 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.0 m -55.23 -42.73 73.77 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 0.0 110.026 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.1 tp -79.34 114.89 18.63 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 104.403 -2.443 . . . . 0.0 104.403 168.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -51.6 131.9 30.04 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.761 0.824 . . . . 0.0 111.904 -169.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.6 m -58.1 -35.56 71.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.699 1.599 . . . . 0.0 110.649 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -155.24 151.34 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 -176.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -117.27 -30.42 5.6 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 117.585 -1.198 . . . . 0.0 111.747 -173.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.58 166.6 26.71 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 119.837 1.199 . . . . 0.0 111.656 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.1 mt -137.03 136.45 47.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.171 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.4 mt -133.3 148.22 51.91 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.7 mt -139.06 118.18 13.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 103.984 -2.598 . . . . 0.0 103.984 169.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 66.4 mt -122.68 146.71 47.23 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -173.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.3 168.81 8.16 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.219 0.533 . . . . 0.0 110.31 169.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -12.23 1.54 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 116.329 1.974 . . . . 0.0 116.329 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -115.97 3.64 13.69 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.94 1.296 . . . . 0.0 110.919 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.99 5.23 55.06 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.073 1.32 . . . . 0.0 113.084 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -69.8 133.76 47.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.426 1.613 . . . . 0.0 109.89 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -61.15 123.87 18.94 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 118.504 0.593 . . . . 0.0 109.653 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.0 mt -100.08 -40.86 7.4 Favored 'General case' 0 C--N 1.334 -0.097 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 162.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -150.09 152.93 35.55 Favored 'General case' 0 CA--C 1.528 0.117 0 C-N-CA 123.747 0.819 . . . . 0.0 109.458 172.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.17 146.84 19.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 168.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.454 ' HE2' ' H ' ' A' ' 30' ' ' TYR . 0.1 OUTLIER -147.46 146.78 29.67 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 170.437 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.454 ' H ' ' HE2' ' A' ' 29' ' ' LYS . 79.7 m-85 -133.6 151.72 51.75 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.969 1.708 . . . . 0.0 106.662 -177.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -135.92 1.4 2.75 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.869 0.868 . . . . 0.0 111.887 -175.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -133.68 158.31 43.59 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.737 0.815 . . . . 0.0 109.447 -176.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -72.52 5.19 3.17 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.358 2.263 . . . . 0.0 112.609 -173.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 p -62.21 -50.09 73.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.645 1.178 . . . . 0.0 110.532 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -142.68 64.71 15.84 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 124.193 0.997 . . . . 0.0 109.992 -174.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -82.18 -2.02 11.01 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.778 2.319 . . . . 0.0 113.598 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.5 m -138.01 143.68 40.71 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.914 0.886 . . . . 0.0 110.287 -169.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.8 t -45.62 -51.3 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 126.491 1.916 . . . . 0.0 113.127 -169.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -58.67 -46.64 86.75 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.799 0.727 . . . . 0.0 110.893 -176.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -70.37 -34.48 72.65 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.639 0.376 . . . . 0.0 110.165 -178.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -63.2 -52.04 63.87 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.231 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -60.18 -35.35 75.17 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 118.894 0.77 . . . . 0.0 111.348 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.15 -49.92 70.24 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -63.4 -39.47 94.59 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 122.589 0.355 . . . . 0.0 111.023 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -63.07 -40.55 98.03 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.927 1.691 . . . . 0.0 111.564 178.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -69.32 -40.96 77.32 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 121.648 -0.657 . . . . 0.0 110.001 175.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.12 -48.78 73.15 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.979 0.512 . . . . 0.0 110.557 171.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.521 HD13 HD22 ' A' ' 62' ' ' LEU . 2.9 mm -54.86 -59.92 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.228 -0.067 0 C-N-CA 125.133 1.373 . . . . 0.0 108.092 178.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -57.65 -45.33 85.62 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.629 0.772 . . . . 0.0 111.323 -172.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -57.84 -52.92 63.5 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 122.687 0.395 . . . . 0.0 110.507 176.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -63.9 -45.83 87.57 Favored 'General case' 0 C--O 1.23 0.062 0 CA-C-O 119.431 -0.318 . . . . 0.0 110.191 -174.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.2 p -68.27 -32.06 71.96 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 119.205 0.911 . . . . 0.0 111.996 -172.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -73.51 0.55 12.13 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.442 1.019 . . . . 0.0 112.981 177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -136.92 35.42 2.6 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.948 1.299 . . . . 0.0 110.451 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.3 m -135.88 156.98 47.95 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.387 1.875 . . . . 0.0 108.14 -178.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -80.17 86.09 5.64 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.327 1.051 . . . . 0.0 109.055 177.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.7 m -50.57 144.27 8.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -169.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 145.45 -42.84 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.263 1 C-N-CA 133.553 4.741 . . . . 0.0 105.823 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -157.35 160.15 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 124.748 1.219 . . . . 0.0 108.973 -178.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.23 174.57 15.26 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.894 1.678 . . . . 0.0 110.207 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -136.7 116.89 13.46 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.556 -2.016 . . . . 0.0 105.556 176.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.521 HD22 HD13 ' A' ' 48' ' ' ILE . 10.2 mp -127.63 117.79 22.66 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 125.236 1.414 . . . . 0.0 107.296 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 50.68 31.49 5.9 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.121 1.368 . . . . 0.0 112.765 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.03 -16.03 61.59 Favored Glycine 0 CA--C 1.53 1.027 0 C-N-CA 124.859 1.218 . . . . 0.0 113.471 178.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.0 mt -91.21 134.15 34.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 119.456 1.628 . . . . 0.0 109.258 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 61.3 m -76.18 141.82 41.73 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 172.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 94.2 t -133.67 137.87 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -128.65 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 105.676 -1.972 . . . . 0.0 105.676 174.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -158.19 164.72 36.26 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.292 0.496 . . . . 0.0 112.218 -169.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -148.42 171.54 15.88 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.756 1.222 . . . . 0.0 108.352 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 p -145.47 143.91 30.29 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 169.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 17.1 m -147.24 142.89 27.71 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.048 0.939 . . . . 0.0 109.665 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 19.4 mt 63.87 -81.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.382 1.873 . . . . 0.0 111.68 169.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -151.61 27.26 0.65 Allowed 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.354 1.861 . . . . 0.0 109.151 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 56.2 tp -138.98 147.35 42.07 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.967 1.707 . . . . 0.0 110.062 -168.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -129.53 144.99 51.5 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.364 1.466 . . . . 0.0 107.454 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -132.85 137.19 46.63 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.433 1.493 . . . . 0.0 107.236 -172.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -146.13 151.19 37.27 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.728 0.695 . . . . 0.0 110.479 -175.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 95.0 t -138.22 141.58 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 105.018 -2.215 . . . . 0.0 105.018 169.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -134.22 141.12 44.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 -172.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.89 -178.91 36.2 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 121.739 0.633 . . . . 0.0 113.062 -179.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -62.57 164.8 7.04 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 113.973 -1.114 . . . . 0.0 110.205 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.1 m -124.68 43.96 2.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.866 0.866 . . . . 0.0 111.021 -169.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -71.91 -166.64 0.23 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 122.863 0.465 . . . . 0.0 110.21 169.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -58.41 -3.6 0.3 Allowed 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 117.049 2.24 . . . . 0.0 117.049 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -149.69 167.69 25.71 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 120.27 1.396 . . . . 0.0 111.211 176.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.82 -0.91 2.78 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.486 2.715 . . . . 0.0 110.295 -178.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.8 mt -63.65 -32.55 74.06 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.792 1.237 . . . . 0.0 109.937 -175.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -34.53 78.51 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 118.896 0.771 . . . . 0.0 111.355 175.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 54.4 mt -70.57 -45.19 65.87 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 177.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.5 mtp -58.94 -37.43 76.71 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.832 174.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.13 74.02 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.776 0.83 . . . . 0.0 110.364 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.6 t -59.05 -46.34 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 33.7 tp -58.05 -49.96 75.1 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.993 0.517 . . . . 0.0 110.366 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -63.6 -43.55 96.6 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 119.116 -0.469 . . . . 0.0 110.913 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.3 m -64.21 -42.18 96.73 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 118.491 0.587 . . . . 0.0 110.709 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.3 tp -67.93 -46.62 71.0 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.638 0.654 . . . . 0.0 110.241 -179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -62.34 -42.95 99.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.679 0.392 . . . . 0.0 111.046 -178.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -76.58 -37.93 55.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.364 -0.835 . . . . 0.0 111.174 -176.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.7 p -63.13 -39.67 95.35 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.641 1.11 . . . . 0.0 110.442 175.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 11.6 mt -54.35 -52.64 60.96 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 20.4 m -56.21 -33.42 65.32 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 122.885 0.474 . . . . 0.0 111.928 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -69.25 -59.24 3.14 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.086 173.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 6.6 ptt? -69.6 -31.52 69.71 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 120.061 1.301 . . . . 0.0 113.472 -169.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.6 mp -69.84 -35.42 74.73 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.824 0.738 . . . . 0.0 111.794 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? 49.08 33.29 4.65 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.424 1.09 . . . . 0.0 112.039 -171.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -155.21 175.66 13.57 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 127.076 2.151 . . . . 0.0 106.585 172.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -62.48 136.31 57.84 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -76.16 51.97 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 126.204 1.802 . . . . 0.0 111.02 -174.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.08 169.99 17.36 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.508 1.123 . . . . 0.0 111.745 -177.369 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -47.47 -55.42 9.09 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.366 1.866 . . . . 0.0 112.799 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -66.36 -38.27 87.19 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.745 -0.645 . . . . 0.0 110.221 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.76 -35.84 82.38 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.337 0.971 . . . . 0.0 110.864 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.99 -42.88 80.12 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 118.94 0.791 . . . . 0.0 110.685 171.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 58.1 tp -58.26 -37.4 74.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.667 0.667 . . . . 0.0 111.211 176.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -69.61 -18.45 63.61 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.104 0.962 . . . . 0.0 113.011 175.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -126.23 24.67 6.8 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.225 1.01 . . . . 0.0 111.525 -171.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.6 mmt -44.35 -49.34 9.6 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.475 1.51 . . . . 0.0 112.424 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.63 -42.48 98.94 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 119.205 0.911 . . . . 0.0 110.952 -177.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.95 -43.88 98.24 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tp -60.14 -50.46 73.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.391 1.076 . . . . 0.0 110.837 175.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.8 m-30 -55.06 -48.78 73.0 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.383 0.673 . . . . 0.0 109.871 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 97.1 mt -71.27 -32.27 68.5 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.701 -0.666 . . . . 0.0 111.416 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.46 -44.56 96.12 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.288 0.949 . . . . 0.0 109.71 173.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 52.4 t -59.35 -47.89 88.97 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 118.794 0.725 . . . . 0.0 109.638 174.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -61.12 -26.73 67.87 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.646 0.609 . . . . 0.0 112.646 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -87.9 -28.95 21.22 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.118 0.967 . . . . 0.0 111.515 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.9 mt -77.11 -43.35 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-N 119.089 0.859 . . . . 0.0 109.507 177.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 p -142.01 146.77 22.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.03 0.932 . . . . 0.0 110.39 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -144.49 138.93 27.95 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 125.02 1.328 . . . . 0.0 107.424 169.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.73 29.53 49.72 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.573 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.48 19.88 79.73 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 118.201 1.001 . . . . 0.0 113.417 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 61.3 t -130.94 133.59 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 11.6 pt -64.61 146.91 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.84 -12.35 3.75 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.888 0.875 . . . . 0.0 111.401 174.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.87 156.0 43.26 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 106.876 -1.527 . . . . 0.0 106.876 169.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 49.7 m -151.76 41.66 0.69 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.422 1.089 . . . . 0.0 109.735 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -142.36 120.5 7.44 Favored Pre-proline 0 C--O 1.235 0.299 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 174.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.81 -28.93 19.58 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.237 1.958 . . . . 0.0 111.775 -169.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -70.98 -39.96 72.19 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 -178.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -69.78 -41.39 75.2 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 118.89 0.768 . . . . 0.0 109.609 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 42.1 t -55.3 -56.27 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 175.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.16 -34.6 71.27 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-N 118.979 0.809 . . . . 0.0 110.819 -174.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -59.17 -50.77 72.76 Favored 'General case' 0 C--N 1.341 0.225 0 CA-C-N 119.039 0.836 . . . . 0.0 109.904 176.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 77.7 mtt180 -62.05 -40.3 95.29 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.881 -0.512 . . . . 0.0 111.135 177.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 65.3 t -64.07 -37.48 79.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.777 0.717 . . . . 0.0 110.654 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.35 -37.71 71.67 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.755 1.162 . . . . 0.0 111.071 175.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 65.0 tp -70.18 -26.09 63.74 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.48 1.912 . . . . 0.0 112.698 -177.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 C-N-CA 124.861 1.264 . . . . 0.0 112.184 -176.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.209 0 N-CA-C 110.421 -0.214 . . . . 0.0 110.421 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.15 -14.83 57.68 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.009 1.114 . . . . 0.0 114.009 -173.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.86 -7.74 55.22 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.185 -0.947 . . . . 0.0 112.666 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.7 tp -142.08 -34.34 0.46 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.168 0.894 . . . . 0.0 112.542 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.3 mt -134.26 55.0 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 -175.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.48 -36.51 73.86 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.473 0.709 . . . . 0.0 109.87 172.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -138.4 147.45 55.39 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 126.31 1.844 . . . . 0.0 106.214 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.79 169.12 21.93 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.729 2.286 . . . . 0.0 110.926 173.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.4 m -130.26 23.74 5.2 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.88 1.272 . . . . 0.0 110.202 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.6 pp -152.36 169.47 22.46 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 127.007 2.123 . . . . 0.0 108.878 -171.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -91.64 154.38 19.06 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.674 0.79 . . . . 0.0 109.867 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 m -65.35 -41.21 94.08 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 169.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -139.36 139.3 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.119 0 C-N-CA 123.85 0.86 . . . . 0.0 108.739 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -83.53 -37.83 22.53 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 169.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.61 168.28 20.17 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 118.513 0.597 . . . . 0.0 112.125 -173.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mt -133.28 137.47 53.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 N-CA-C 104.94 -2.244 . . . . 0.0 104.94 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.9 mt -133.76 157.7 45.2 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.521 0.728 . . . . 0.0 109.373 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.489 ' CG2' HD11 ' A' ' 75' ' ' LEU . 9.8 mm -138.31 119.77 17.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 103.368 -2.827 . . . . 0.0 103.368 169.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -122.54 144.73 48.9 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.705 0.764 . . . . 0.0 109.158 -174.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -67.87 169.7 9.37 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 114.582 -1.19 . . . . 0.0 108.767 169.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -77.22 36.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.883 2.073 . . . . 0.0 111.389 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -149.62 7.26 0.65 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.278 2.231 . . . . 0.0 110.816 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.19 47.1 74.9 Favored Glycine 0 C--N 1.343 0.946 0 O-C-N 121.053 -1.029 . . . . 0.0 110.548 -174.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -122.99 133.26 54.37 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.178 0.991 . . . . 0.0 108.873 -177.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -64.76 119.38 10.48 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -173.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.1 mt -92.42 -42.38 9.79 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 159.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -148.65 154.69 40.03 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.803 0.841 . . . . 0.0 109.886 171.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.11 148.98 22.56 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 168.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.459 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -140.88 137.09 32.94 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 171.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -124.26 146.87 48.49 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -130.09 3.83 4.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.751 0.82 . . . . 0.0 110.992 -176.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -136.49 153.13 51.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.667 0.787 . . . . 0.0 111.054 -174.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -72.37 -0.49 12.54 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.285 2.234 . . . . 0.0 113.076 -173.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.7 p -65.6 -38.21 88.8 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.992 -1.068 . . . . 0.0 111.578 173.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -143.41 64.69 14.1 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 119.031 0.832 . . . . 0.0 110.467 -177.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -86.78 -1.02 8.11 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.851 2.367 . . . . 0.0 113.083 -175.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.6 m -133.71 137.51 45.31 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.399 1.08 . . . . 0.0 109.224 -169.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -50.64 -44.41 25.4 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.188 0 C-N-CA 125.048 1.339 . . . . 0.0 113.47 -169.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -57.98 -45.77 86.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.667 0.667 . . . . 0.0 111.135 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.08 -35.98 64.28 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 -178.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -60.26 -52.56 64.77 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.178 0.591 . . . . 0.0 109.887 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -57.78 -39.73 78.18 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.595 0.758 . . . . 0.0 110.647 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.65 83.71 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.098 0.559 . . . . 0.0 110.184 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -64.08 -38.66 91.87 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.44 0.696 . . . . 0.0 110.952 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -60.21 -46.56 89.33 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.631 1.972 . . . . 0.0 110.711 174.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 68.5 mmtt -60.89 -46.29 91.2 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.026 0.83 . . . . 0.0 110.228 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -47.04 77.65 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.503 0.721 . . . . 0.0 110.752 177.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 39.4 mt -60.81 -51.34 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.13 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.035 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -60.66 -46.56 89.87 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.892 0.769 . . . . 0.0 110.272 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -55.37 -43.71 75.36 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.455 1.102 . . . . 0.0 111.736 178.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -75.24 -49.73 18.4 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.999 0.52 . . . . 0.0 110.417 -177.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.1 p -68.57 -30.66 69.47 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.731 -0.605 . . . . 0.0 111.887 -172.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -58.22 -23.85 57.16 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.291 -0.881 . . . . 0.0 111.541 171.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.41 20.95 17.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.487 1.515 . . . . 0.0 110.339 -177.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 84.4 m -125.29 156.6 38.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.789 1.236 . . . . 0.0 108.949 -177.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -84.62 35.1 0.55 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.526 1.53 . . . . 0.0 112.679 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 6.7 m 65.86 -176.91 0.19 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.249 1.82 . . . . 0.0 113.446 178.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.312 9.6 pt-20 56.31 -42.11 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 131.536 3.934 . . . . 0.0 117.006 -176.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.7 tt -158.02 151.83 7.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 120.245 1.384 . . . . 0.0 110.024 -173.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.81 177.74 9.27 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.434 1.893 . . . . 0.0 108.291 170.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 6.7 tt -140.57 125.61 18.43 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 104.773 -2.306 . . . . 0.0 104.773 170.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -77.29 -65.88 0.9 Allowed 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -169.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -142.72 4.04 1.49 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.195 1.798 . . . . 0.0 110.915 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 153.48 -40.95 0.67 Allowed Glycine 0 CA--C 1.525 0.666 0 C-N-CA 125.773 1.654 . . . . 0.0 109.319 -175.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -65.84 126.91 29.96 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 170.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.1 m -80.22 146.21 31.84 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.422 -1.325 . . . . 0.0 107.422 172.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 7.4 p -136.71 121.15 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 173.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.42 142.4 13.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 103.865 -2.642 . . . . 0.0 103.865 168.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.42 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 16.2 p90 -152.43 167.11 29.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.555 0.693 . . . . 0.0 110.892 176.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -154.78 154.26 32.52 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 -172.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.8 m -140.01 130.93 26.1 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -149.92 148.21 28.83 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 123.179 0.591 . . . . 0.0 109.633 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.4 mp 53.28 -89.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.772 2.029 . . . . 0.0 111.147 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -147.6 33.97 0.86 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.772 2.029 . . . . 0.0 108.903 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.489 HD11 ' CG2' ' A' ' 18' ' ' ILE . 50.3 tp -140.19 150.65 44.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.69 1.596 . . . . 0.0 110.47 -168.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -126.28 144.76 50.68 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -129.61 143.83 51.0 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 126.284 1.834 . . . . 0.0 107.764 -173.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -149.52 150.35 32.17 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.459 1.027 . . . . 0.0 111.774 -172.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.5 t -139.58 119.66 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -104.53 138.01 31.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 106.187 -1.782 . . . . 0.0 106.187 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -153.68 176.73 31.54 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-O 122.369 0.983 . . . . 0.0 112.666 177.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.8 m -61.49 157.05 17.95 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 125.619 1.568 . . . . 0.0 112.328 -172.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.3 m -72.92 34.38 0.07 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.01 2.124 . . . . 0.0 112.083 175.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -70.28 176.98 3.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.429 1.492 . . . . 0.0 111.355 -172.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -63.96 -12.91 41.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.07 1.748 . . . . 0.0 112.963 -177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -144.75 161.61 38.8 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 123.85 0.86 . . . . 0.0 110.581 176.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -9.23 8.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 128.559 2.744 . . . . 0.0 110.202 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.23 -31.93 69.51 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.903 1.281 . . . . 0.0 110.609 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -64.56 -35.59 81.48 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 119.396 0.998 . . . . 0.0 111.96 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.96 -43.14 72.15 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 30.8 tpp -64.88 -33.88 77.05 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.131 0.572 . . . . 0.0 111.174 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.42 -50.41 67.7 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.749 1.22 . . . . 0.0 109.949 174.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 41.9 t -60.17 -44.97 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.336 0.516 . . . . 0.0 110.097 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -58.93 -53.01 63.17 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.339 0.656 . . . . 0.0 110.091 179.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -60.39 -43.54 96.56 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.884 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 93.6 m -61.15 -45.9 92.76 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.257 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.0 tp -64.37 -49.35 71.97 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.999 0.818 . . . . 0.0 110.406 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -59.46 -46.62 88.27 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.47 0.176 . . . . 0.0 110.847 -179.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -69.23 -38.44 78.51 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 118.813 -0.613 . . . . 0.0 111.03 -176.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.1 m -59.5 -50.96 71.9 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.799 0.84 . . . . 0.0 110.803 176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.5 mt -54.91 -45.97 74.82 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.7 m -61.33 -37.38 83.09 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.791 179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -68.82 -55.51 10.95 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 120.091 1.314 . . . . 0.0 109.432 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.9 ptt? -74.16 -36.97 64.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.699 -169.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 14.6 tp -82.93 -28.76 29.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.887 0.767 . . . . 0.0 111.918 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.312 0.0 OUTLIER 40.11 54.01 2.74 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.771 1.628 . . . . 0.0 112.831 -171.052 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -135.16 -179.51 5.67 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.89 2.076 . . . . 0.0 106.914 169.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -1.49 12.39 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 177.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.313 11.9 m 48.47 38.75 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 127.161 2.184 . . . . 0.0 111.87 -174.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -66.21 171.26 4.87 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.259 1.023 . . . . 0.0 110.023 171.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 21.6 pttt -60.54 -37.74 82.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -62.04 -45.47 93.41 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 119.495 1.043 . . . . 0.0 110.003 172.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -68.78 -33.1 73.3 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 122.512 0.325 . . . . 0.0 111.125 -174.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.326 0.0 OUTLIER -81.16 -32.93 33.42 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 120.518 -1.364 . . . . 0.0 110.95 176.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.3 tp -60.95 -36.74 80.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.293 0.951 . . . . 0.0 111.22 169.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.12 -7.96 59.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.319 -0.863 . . . . 0.0 112.845 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.82 30.79 5.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.457 1.103 . . . . 0.0 112.702 175.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -41.07 -46.08 2.84 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.167 1.387 . . . . 0.0 112.667 174.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.98 -40.55 96.65 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 119.056 0.843 . . . . 0.0 111.451 -177.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -63.8 -42.79 98.4 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 176.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.4 tp -57.58 -49.56 75.97 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.414 1.086 . . . . 0.0 110.543 173.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -56.09 -47.25 78.36 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 118.693 0.679 . . . . 0.0 109.734 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.5 mt -67.74 -36.98 81.53 Favored 'General case' 0 CA--C 1.527 0.072 0 CA-C-O 118.859 -0.591 . . . . 0.0 111.121 -178.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.55 -45.37 93.26 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 119.076 0.853 . . . . 0.0 110.054 175.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.07 -49.4 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 118.673 0.67 . . . . 0.0 109.348 176.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.49 -23.29 62.64 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.415 1.086 . . . . 0.0 113.05 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -97.21 -19.59 18.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.655 1.182 . . . . 0.0 111.809 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 61.2 mt -88.79 -40.86 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-N 119.394 0.997 . . . . 0.0 109.474 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.2 m -140.32 145.27 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 C-N-CA 124.97 1.308 . . . . 0.0 109.539 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -144.61 134.32 23.57 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.625 1.57 . . . . 0.0 107.302 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.44 28.67 51.48 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.369 -0.684 . . . . 0.0 113.07 -176.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.09 15.98 81.12 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-N 118.23 1.015 . . . . 0.0 113.678 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 59.4 t -131.6 140.07 49.12 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 119.326 1.563 . . . . 0.0 107.517 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.0 pt -62.46 146.12 12.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.975 -0.453 . . . . 0.0 110.522 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.55 -5.39 3.29 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.739 0.815 . . . . 0.0 112.392 172.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -153.57 154.55 34.47 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 169.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 12.2 m -140.1 24.46 2.34 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.654 1.182 . . . . 0.0 110.856 -171.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -140.15 122.61 9.96 Favored Pre-proline 0 C--O 1.234 0.251 0 C-N-CA 124.476 1.11 . . . . 0.0 108.201 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.92 -30.45 16.89 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.379 2.053 . . . . 0.0 111.819 -169.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -70.28 -41.24 73.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 O-C-N 121.473 -0.767 . . . . 0.0 109.11 -179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -66.97 -39.48 87.22 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.676 0.671 . . . . 0.0 109.905 177.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.4 t -52.96 -55.59 11.42 Favored 'Isoleucine or valine' 0 C--N 1.34 0.162 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 38.2 t -59.57 -39.19 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 CA-C-O 118.489 -0.767 . . . . 0.0 111.37 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -60.36 -46.55 89.56 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.513 1.051 . . . . 0.0 110.743 176.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -72.68 -31.79 65.31 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.862 1.21 . . . . 0.0 111.754 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.92 -41.49 89.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 119.393 0.997 . . . . 0.0 109.432 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.38 -35.78 71.2 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.033 0.533 . . . . 0.0 111.85 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 53.8 mt -74.32 -25.97 59.88 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.889 0.875 . . . . 0.0 112.397 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 59.2 mtt85 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.272 -0.871 . . . . 0.0 110.295 171.327 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.4 mmt . . . . . 0 N--CA 1.485 1.277 0 CA-C-O 120.739 0.304 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -63.89 -32.13 73.55 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.453 0.701 . . . . 0.0 111.669 177.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.74 160.1 43.81 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.796 1.638 . . . . 0.0 108.252 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 tp -54.19 -33.16 57.5 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.168 1.387 . . . . 0.0 112.481 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 pp -129.49 40.48 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.616 1.966 . . . . 0.0 109.53 -177.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -53.09 -38.79 62.87 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 169.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -134.3 147.56 64.15 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 104.967 -2.235 . . . . 0.0 104.967 168.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -80.24 45.17 1.9 Allowed 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.788 2.992 . . . . 0.0 111.409 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.2 p -77.52 46.26 0.52 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.275 1.83 . . . . 0.0 111.912 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -147.52 172.17 14.41 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 127.126 2.17 . . . . 0.0 109.033 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -137.39 154.68 49.95 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.506 0.723 . . . . 0.0 110.903 -170.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 m -60.41 -34.28 73.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.505 1.122 . . . . 0.0 110.414 176.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.6 p -152.45 142.38 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.0 mmtt -96.16 -41.7 8.57 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.412 1.085 . . . . 0.0 109.593 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.15 168.33 20.95 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 118.401 0.546 . . . . 0.0 111.642 -175.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.4 mt -135.9 137.08 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 127.292 2.237 . . . . 0.0 104.986 173.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 mt -133.89 151.26 51.45 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 176.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' CG2' HD11 ' A' ' 75' ' ' LEU . 62.6 mt -136.83 120.49 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 103.691 -2.707 . . . . 0.0 103.691 169.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.6 mt -123.68 148.84 46.14 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.733 0.813 . . . . 0.0 108.818 -169.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -65.68 172.25 3.6 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.685 0.755 . . . . 0.0 109.439 170.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -66.89 7.07 0.41 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.389 1.876 . . . . 0.0 114.054 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -131.66 11.0 4.79 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.873 1.669 . . . . 0.0 110.839 175.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.46 4.37 83.36 Favored Glycine 0 CA--C 1.531 1.064 0 O-C-N 121.271 -0.893 . . . . 0.0 113.538 176.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -69.72 130.51 42.53 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.024 1.412 . . . . 0.0 110.197 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.3 ttt180 -67.14 105.5 1.71 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 124.397 1.079 . . . . 0.0 110.595 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.9 mt -81.55 -43.96 17.99 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 166.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -147.08 152.91 39.29 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.037 0.935 . . . . 0.0 109.741 174.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.11 149.98 19.88 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 124.045 0.938 . . . . 0.0 108.875 168.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -143.18 139.9 30.53 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 125.564 1.546 . . . . 0.0 106.941 169.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -127.27 150.11 49.71 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -129.29 -2.84 4.99 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -171.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.4 t0 -138.04 173.11 11.98 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.141 0.882 . . . . 0.0 110.921 -176.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -72.09 61.99 0.45 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.799 2.439 . . . . 0.0 109.044 174.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 98.6 m -154.31 91.99 1.47 Allowed 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 102.638 -3.097 . . . . 0.0 102.638 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 55.43 60.9 8.91 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.377 1.471 . . . . 0.0 111.042 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -79.98 -2.73 12.3 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.5 2.133 . . . . 0.0 113.731 -175.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.7 m -136.22 141.88 44.01 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.379 0.99 . . . . 0.0 109.853 -169.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.2 t -43.92 -52.05 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 126.529 1.932 . . . . 0.0 113.326 -169.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -58.92 -42.72 90.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.527 0.603 . . . . 0.0 111.206 -176.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.69 -32.39 63.91 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.678 0.391 . . . . 0.0 110.175 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.9 mt-30 -63.93 -48.83 74.98 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 123.232 0.613 . . . . 0.0 109.848 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -58.48 -35.74 72.66 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 118.754 0.706 . . . . 0.0 111.39 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.74 -48.74 70.89 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -63.3 -37.44 87.27 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.866 0.466 . . . . 0.0 111.189 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -65.7 -45.2 83.71 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.88 1.672 . . . . 0.0 111.004 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -60.8 -44.55 96.71 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.939 -0.475 . . . . 0.0 109.902 173.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.36 -46.51 79.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.251 0.62 . . . . 0.0 111.355 174.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.411 HD13 HD22 ' A' ' 62' ' ' LEU . 2.5 mm -57.59 -55.7 19.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 C-N-CA 124.468 1.107 . . . . 0.0 108.312 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -64.92 -41.04 95.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 117.982 0.356 . . . . 0.0 110.539 -175.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 34.5 t30 -59.42 -41.04 88.61 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.866 -0.521 . . . . 0.0 111.804 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.0 mmmt -81.3 -45.71 15.8 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.22 0.463 . . . . 0.0 110.346 -174.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.6 p -70.44 -26.89 63.86 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -169.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -74.2 -3.82 32.18 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.248 1.385 . . . . 0.0 112.091 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 80.3 mtt-85 -113.58 16.39 18.71 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 110.075 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.5 m -131.89 157.64 43.45 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.108 1.363 . . . . 0.0 108.599 -169.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -78.01 85.55 4.23 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.477 1.111 . . . . 0.0 109.67 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.5 m -47.07 136.85 8.22 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.051 1.74 . . . . 0.0 115.509 -169.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 147.06 -39.42 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.454 1 C-N-CA 132.906 4.482 . . . . 0.0 107.433 173.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.5 tt -152.29 156.82 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.561 1.544 . . . . 0.0 108.485 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -152.36 171.02 18.67 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.752 2.021 . . . . 0.0 108.721 174.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 17.8 tp -133.45 114.31 13.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 174.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.411 HD22 HD13 ' A' ' 48' ' ' ILE . 10.9 mp -114.24 98.82 7.17 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -174.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 57.72 14.33 2.39 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.224 1.81 . . . . 0.0 114.193 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 133.43 -31.2 2.9 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.683 1.611 . . . . 0.0 111.768 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 64.7 mt -83.28 129.94 35.04 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 118.433 1.116 . . . . 0.0 109.208 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -74.76 141.66 44.39 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 171.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 97.5 t -137.54 131.51 44.06 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.093 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.5 m -118.38 144.75 25.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 169.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -162.18 164.3 27.9 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.907 0.384 . . . . 0.0 111.803 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -150.04 175.01 12.1 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.024 0.93 . . . . 0.0 108.594 169.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.3 p -139.61 145.35 38.43 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -145.69 137.9 25.52 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 11.8 mt 64.77 -82.59 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 C-N-CA 126.21 1.804 . . . . 0.0 110.896 170.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -152.9 28.8 0.52 Allowed 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.392 1.877 . . . . 0.0 108.934 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.473 HD11 ' CG2' ' A' ' 18' ' ' ILE . 47.6 tp -139.4 146.3 39.99 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 125.984 1.714 . . . . 0.0 109.428 -168.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -126.07 145.97 50.11 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.142 1.377 . . . . 0.0 107.482 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -136.21 138.07 41.5 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 -170.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -145.85 149.3 34.03 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.875 0.87 . . . . 0.0 111.359 -170.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.8 t -138.15 138.62 43.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 169.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -130.08 139.25 51.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -172.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -156.81 177.7 33.6 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-O 122.118 0.843 . . . . 0.0 112.594 -173.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 43.4 m -59.54 162.24 5.18 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.678 1.591 . . . . 0.0 112.452 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 1.3 m -71.84 27.46 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.698 1.999 . . . . 0.0 112.207 171.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -71.78 173.46 8.17 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.384 1.073 . . . . 0.0 112.142 -169.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.38 -7.59 38.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.74 1.616 . . . . 0.0 113.328 -172.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -141.8 159.87 41.33 Favored 'General case' 0 C--N 1.339 0.126 0 CA-C-N 119.061 0.846 . . . . 0.0 110.36 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.49 -6.57 10.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.322 2.249 . . . . 0.0 110.317 173.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -36.36 71.81 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.961 1.304 . . . . 0.0 111.099 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 20.5 ptt? -65.86 -33.95 77.02 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.871 0.76 . . . . 0.0 111.675 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 34.3 mt -73.53 -42.48 61.69 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 5.0 mmt -56.64 -40.17 74.94 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.011 0.524 . . . . 0.0 110.06 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.89 -49.33 73.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.546 0.738 . . . . 0.0 109.887 -179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.0 t -60.14 -45.53 95.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 118.118 0.417 . . . . 0.0 110.166 179.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 43.5 tp -60.02 -49.29 78.25 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 122.903 0.481 . . . . 0.0 110.366 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.26 -42.02 96.66 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 118.846 -0.597 . . . . 0.0 110.594 -179.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.2 m -60.11 -48.51 81.43 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.896 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 44.8 tp -64.86 -46.47 81.72 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.566 1.075 . . . . 0.0 111.155 -176.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.29 -46.88 88.31 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 122.999 0.52 . . . . 0.0 110.916 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -77.26 -26.4 52.45 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.33 -0.856 . . . . 0.0 111.641 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.7 m -62.98 -50.29 71.37 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.134 0.879 . . . . 0.0 110.313 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.2 mt -52.0 -47.75 64.79 Favored 'General case' 0 C--N 1.343 0.3 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.7 m -58.92 -25.57 63.57 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 117.706 -1.14 . . . . 0.0 113.909 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -85.58 -53.5 5.13 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 121.041 1.746 . . . . 0.0 110.951 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.2 ptt? -75.18 -38.11 60.98 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.598 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.0 tp -82.0 -39.1 24.08 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.959 0.504 . . . . 0.0 110.062 -179.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.272 26.0 ptt-85 39.05 53.02 2.08 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.162 1.785 . . . . 0.0 112.237 -178.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -131.96 -169.82 2.28 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 128.215 2.606 . . . . 0.0 105.703 169.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -72.48 7.3 1.9 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.296 16.8 m 44.76 41.05 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 126.914 2.086 . . . . 0.0 112.164 -171.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -73.5 160.31 31.89 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.262 1.025 . . . . 0.0 109.485 171.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 33.4 pttt -60.37 -32.49 71.35 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -172.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 -37.44 75.05 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.761 0.424 . . . . 0.0 110.258 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -70.74 -34.83 72.29 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.841 0.456 . . . . 0.0 110.319 173.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.0 mp -60.42 -45.38 93.82 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.962 -1.086 . . . . 0.0 110.441 170.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.79 -39.34 73.92 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.66 0.784 . . . . 0.0 111.094 175.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -63.66 -25.61 68.29 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -129.09 27.38 5.4 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 118.787 0.721 . . . . 0.0 112.689 -171.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -40.7 -48.82 3.02 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 125.074 1.349 . . . . 0.0 112.247 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -63.41 -40.29 96.8 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.819 0.736 . . . . 0.0 111.722 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.17 -44.33 97.87 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.535 -1.026 . . . . 0.0 110.535 175.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.8 tp -58.79 -50.0 75.57 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.464 1.105 . . . . 0.0 110.322 175.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -54.91 -48.78 72.63 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.667 0.667 . . . . 0.0 109.897 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.5 mt -66.91 -37.52 84.51 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 123.181 0.592 . . . . 0.0 111.194 -176.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.08 -45.81 90.38 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 118.655 0.661 . . . . 0.0 109.867 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.3 t -57.31 -44.38 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.564 0.62 . . . . 0.0 109.529 175.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -71.66 1.48 6.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.133 0.973 . . . . 0.0 113.433 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -118.28 -12.03 9.99 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.666 1.586 . . . . 0.0 111.34 172.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 54.6 mt -88.06 -40.57 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 169.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 24.0 t -133.69 145.61 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.319 1.048 . . . . 0.0 110.513 -169.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -144.87 130.7 19.16 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 125.846 1.658 . . . . 0.0 106.898 168.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 55.78 29.61 55.0 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 119.398 -0.668 . . . . 0.0 113.868 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.65 16.22 80.43 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.288 1.044 . . . . 0.0 113.289 179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.5 t -127.91 138.45 54.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 16.9 pt -66.2 147.06 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.6 pp -128.03 -11.69 5.3 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.246 1.018 . . . . 0.0 111.692 177.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -147.79 157.22 43.43 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 106.684 -1.599 . . . . 0.0 106.684 169.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 7.3 m -141.83 26.64 1.88 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.996 0.918 . . . . 0.0 110.862 -172.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -141.97 128.76 11.24 Favored Pre-proline 0 C--O 1.236 0.346 0 C-N-CA 124.084 0.953 . . . . 0.0 108.501 177.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -69.48 -38.55 8.24 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.846 2.364 . . . . 0.0 113.67 -172.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.281 0.0 OUTLIER -76.36 -26.98 56.25 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 120.873 -1.142 . . . . 0.0 110.162 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 -66.18 -44.33 84.32 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.537 1.062 . . . . 0.0 109.618 169.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.4 t -54.88 -51.64 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 118.926 0.785 . . . . 0.0 109.541 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.39 -38.22 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.05 0.841 . . . . 0.0 110.693 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -62.92 -38.85 92.62 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.674 1.125 . . . . 0.0 110.947 177.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 25.2 mtt-85 -64.01 -46.73 83.21 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 118.925 0.784 . . . . 0.0 109.998 175.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 71.7 t -58.34 -41.41 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.95 -33.95 74.54 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.553 0.741 . . . . 0.0 111.994 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 29.9 mt -72.34 -32.15 66.25 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.042 0.937 . . . . 0.0 111.983 177.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.332 -0.842 . . . . 0.0 109.998 176.647 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.483 1.206 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -72.1 -26.91 62.33 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.145 0.884 . . . . 0.0 112.231 -172.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 30.36 -90.6 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 129.19 2.996 . . . . 0.0 114.736 175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp -54.89 -33.83 62.4 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.589 1.155 . . . . 0.0 112.169 -176.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.6 mm -123.21 36.49 1.22 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 125.534 1.534 . . . . 0.0 108.08 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.8 tp -58.98 -31.2 68.55 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.124 -0.985 . . . . 0.0 110.116 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -136.67 155.07 76.93 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 127.05 2.14 . . . . 0.0 106.0 169.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -64.99 145.86 86.32 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.903 1.736 . . . . 0.0 109.763 174.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.1 m -61.5 -29.3 69.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.011 0.924 . . . . 0.0 112.966 -171.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -153.22 178.6 9.57 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.39 1.876 . . . . 0.0 108.595 174.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -50.77 132.01 26.19 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.202 1.001 . . . . 0.0 112.679 -170.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 m -63.15 -38.59 91.79 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.312 1.845 . . . . 0.0 110.637 175.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.7 m -141.66 153.39 19.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 C-N-CA 124.644 1.178 . . . . 0.0 108.036 175.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -111.75 -28.7 7.99 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 117.206 -1.378 . . . . 0.0 110.688 174.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -162.14 166.66 25.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 120.14 1.336 . . . . 0.0 112.38 178.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 58.4 mt -136.21 136.67 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mt -135.41 154.02 51.6 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.048 0.939 . . . . 0.0 108.682 179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.9 mt -138.83 123.87 21.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 104.032 -2.581 . . . . 0.0 104.032 169.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.5 mt -129.15 149.07 51.11 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -171.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -65.61 172.68 3.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.548 170.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -74.4 30.05 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.906 2.083 . . . . 0.0 111.878 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -147.98 7.66 0.83 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.278 2.231 . . . . 0.0 110.79 176.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.54 10.06 86.51 Favored Glycine 0 CA--C 1.531 1.047 0 O-C-N 121.001 -1.062 . . . . 0.0 113.105 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -72.35 129.68 38.97 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 118.751 1.276 . . . . 0.0 109.949 -179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.74 106.84 0.73 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 125.315 1.446 . . . . 0.0 109.996 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 25.3 mt -92.6 -44.41 8.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 166.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -147.29 151.5 36.72 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 123.754 0.822 . . . . 0.0 109.531 172.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -159.89 145.12 15.27 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 169.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -146.98 146.85 30.22 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.939 1.295 . . . . 0.0 108.181 174.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -135.23 149.64 49.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.259 1.424 . . . . 0.0 107.704 -174.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -132.62 0.34 3.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.674 1.19 . . . . 0.0 111.612 -174.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -131.9 160.63 35.17 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.845 0.858 . . . . 0.0 108.796 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -73.26 6.12 3.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.595 1.958 . . . . 0.0 112.897 -170.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 p -61.99 -48.63 79.47 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.823 1.249 . . . . 0.0 110.735 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -144.84 73.48 14.97 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.233 1.013 . . . . 0.0 109.212 -175.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -85.01 -2.51 9.59 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.459 2.106 . . . . 0.0 113.956 -173.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.8 m -137.65 140.73 41.01 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.368 0.985 . . . . 0.0 110.054 -169.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.23 -43.95 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.14 1.376 . . . . 0.0 113.229 -169.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -59.26 -38.29 79.71 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 117.799 0.272 . . . . 0.0 111.428 -176.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -85.84 -32.51 21.69 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.012 0.369 . . . . 0.0 110.236 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.6 -51.88 66.71 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 123.269 0.628 . . . . 0.0 110.201 176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -60.41 -31.67 70.6 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 121.546 -0.721 . . . . 0.0 111.348 178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.81 -48.13 67.13 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 176.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -61.51 -36.55 80.84 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.031 0.532 . . . . 0.0 111.055 177.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 -66.83 -44.08 82.04 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.602 1.561 . . . . 0.0 111.311 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -60.71 -44.11 97.0 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 121.677 -0.639 . . . . 0.0 110.014 172.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.66 -45.95 81.37 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.599 0.76 . . . . 0.0 111.224 174.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.62 -53.35 45.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 C-N-CA 124.259 1.024 . . . . 0.0 108.474 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -62.5 -46.05 90.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.477 0.58 . . . . 0.0 110.362 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 23.8 t30 -56.09 -42.45 76.76 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.997 0.919 . . . . 0.0 111.915 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -78.69 -47.83 16.17 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.171 0.589 . . . . 0.0 110.156 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.0 p -66.88 -30.38 70.52 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.54 -0.725 . . . . 0.0 111.851 -175.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -59.71 -20.72 58.24 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.363 -0.835 . . . . 0.0 112.23 172.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -108.58 17.63 21.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.842 1.657 . . . . 0.0 110.433 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 56.4 m -121.61 163.33 19.13 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.89 1.276 . . . . 0.0 108.942 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -95.63 25.5 4.52 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.076 1.75 . . . . 0.0 113.333 -169.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 69' ' ' TYR . 8.0 m 73.82 176.88 0.24 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.315 1.846 . . . . 0.0 113.227 172.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.319 10.5 pt-20 56.33 -43.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 131.072 3.749 . . . . 0.0 116.354 -173.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.1 tt -148.11 155.85 9.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 120.303 1.411 . . . . 0.0 109.766 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.85 167.03 27.74 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.248 2.219 . . . . 0.0 108.133 176.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 19.7 tp -135.08 116.07 14.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 175.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 10.7 mp -117.35 97.29 5.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -172.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 57.45 15.92 2.97 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.225 1.81 . . . . 0.0 114.082 171.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 129.99 -28.36 3.91 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.7 1.619 . . . . 0.0 111.971 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.3 mt -82.26 128.27 34.02 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.474 1.137 . . . . 0.0 109.178 -179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.8 m -75.88 138.24 40.94 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 172.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 73.9 t -136.9 133.48 48.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 106.398 -1.705 . . . . 0.0 106.398 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.8 m -118.87 146.85 22.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 106.738 -1.578 . . . . 0.0 106.738 169.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.441 ' CZ ' ' HA ' ' A' ' 57' ' ' SER . 19.4 p90 -158.16 162.77 37.96 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.166 0.508 . . . . 0.0 110.981 -175.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -148.16 174.76 11.64 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.236 1.014 . . . . 0.0 108.418 170.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -139.76 146.58 39.69 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 169.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.1 m -142.45 137.66 30.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 123.89 0.876 . . . . 0.0 108.691 177.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 17.8 mt 63.17 -76.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 127.26 2.224 . . . . 0.0 110.805 172.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -156.37 31.35 0.33 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.719 1.608 . . . . 0.0 109.999 176.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.1 tp -140.17 149.46 43.0 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 125.293 1.437 . . . . 0.0 109.421 -169.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -124.19 149.97 45.75 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.761 0.824 . . . . 0.0 109.537 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -139.77 142.91 36.72 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.369 1.468 . . . . 0.0 107.862 -172.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -147.44 152.43 38.08 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 123.666 0.786 . . . . 0.0 111.189 -170.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.7 t -138.9 140.14 39.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 104.787 -2.301 . . . . 0.0 104.787 169.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -130.47 140.56 48.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 -174.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.54 -179.86 34.64 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-O 122.664 1.147 . . . . 0.0 112.074 -177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.4 m -64.69 164.74 11.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.735 1.614 . . . . 0.0 112.557 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.2 p -74.02 37.93 0.1 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.997 2.119 . . . . 0.0 111.377 170.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -68.03 169.4 10.15 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.577 1.151 . . . . 0.0 110.819 -175.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.48 -4.18 21.51 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.651 1.18 . . . . 0.0 113.558 -174.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -149.35 172.63 14.6 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.368 1.467 . . . . 0.0 108.786 169.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -132.38 -1.98 3.51 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.055 2.542 . . . . 0.0 110.256 -176.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 76.0 mt -64.49 -30.9 71.93 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.737 1.215 . . . . 0.0 110.51 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -35.06 79.28 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 119.263 0.938 . . . . 0.0 111.497 172.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -69.37 -46.41 67.02 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.1 mmt -55.25 -41.35 72.03 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.39 174.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.13 -50.08 71.85 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.005 0.922 . . . . 0.0 110.038 -179.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.33 -43.77 97.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.217 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 56.2 tp -60.89 -48.9 79.69 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 118.482 0.583 . . . . 0.0 110.486 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -63.67 -44.11 94.73 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.351 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 92.5 m -60.35 -47.06 87.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 118.881 -0.58 . . . . 0.0 110.147 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 48.6 tp -64.86 -49.12 71.78 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 119.057 0.844 . . . . 0.0 110.787 -177.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.59 -42.36 98.75 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.175 0.443 . . . . 0.0 110.927 -177.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -73.14 -36.63 66.71 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.49 -0.756 . . . . 0.0 111.173 -177.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 20.8 m -63.76 -43.34 96.71 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.971 0.805 . . . . 0.0 110.85 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.8 mt -53.7 -50.35 66.07 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.9 m -57.18 -38.69 73.99 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.368 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -66.6 -49.54 66.0 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.35 -0.833 . . . . 0.0 111.54 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 4.2 ptp -69.99 -34.98 74.03 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 119.379 0.99 . . . . 0.0 111.211 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -72.43 -43.14 64.26 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.868 0.467 . . . . 0.0 111.024 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 51.96 27.21 4.2 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.065 1.346 . . . . 0.0 112.437 -169.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -156.59 -175.62 5.53 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.177 2.191 . . . . 0.0 107.676 177.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -46.85 123.45 5.18 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.992 1.317 . . . . 0.0 110.233 174.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 17.2 m -84.91 51.05 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.993 1.317 . . . . 0.0 108.974 171.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -85.11 178.21 7.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.364 1.066 . . . . 0.0 111.652 179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -47.73 -54.28 12.65 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.65 1.18 . . . . 0.0 112.718 -175.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -65.04 -41.37 95.28 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 118.313 0.506 . . . . 0.0 109.733 -176.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.83 76.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.151 0.581 . . . . 0.0 111.97 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -69.54 -49.56 53.21 Favored 'General case' 0 CA--C 1.522 -0.121 0 C-N-CA 123.984 0.914 . . . . 0.0 110.253 171.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 64.6 tp -56.33 -37.41 69.92 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.808 0.843 . . . . 0.0 111.263 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -81.98 -3.31 54.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.543 0.737 . . . . 0.0 112.339 -178.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 -132.91 22.43 4.19 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.786 1.235 . . . . 0.0 112.209 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.19 -43.4 21.36 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.207 1.003 . . . . 0.0 111.724 179.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.26 -42.88 92.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.853 0.752 . . . . 0.0 111.466 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.14 -41.49 99.7 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 177.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tp -58.16 -48.92 78.79 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.559 1.144 . . . . 0.0 110.672 173.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.09 -45.52 83.29 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 118.808 0.731 . . . . 0.0 109.683 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.68 -35.38 78.73 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.164 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.25 89.7 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 119.081 0.855 . . . . 0.0 110.145 175.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 45.1 t -57.52 -47.74 84.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.11 -21.73 63.99 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.487 1.115 . . . . 0.0 113.158 178.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -97.64 -22.8 16.28 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.277 1.031 . . . . 0.0 111.562 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 67.4 mt -83.13 -45.29 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.3 0.954 . . . . 0.0 108.976 177.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 1.8 m -139.89 153.26 22.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 124.413 1.085 . . . . 0.0 110.684 -171.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -149.32 140.69 23.24 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.347 1.459 . . . . 0.0 107.85 169.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.45 28.01 54.84 Favored Glycine 0 CA--C 1.532 1.149 0 CA-C-O 119.464 -0.631 . . . . 0.0 113.463 177.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.68 17.79 79.57 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.194 0.997 . . . . 0.0 113.41 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 56.4 t -132.41 142.08 43.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 119.07 1.435 . . . . 0.0 107.383 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 27.6 pt -65.18 151.21 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 O-C-N 121.976 -0.452 . . . . 0.0 110.284 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.9 pp -134.32 -10.58 2.52 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.867 0.867 . . . . 0.0 111.939 170.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -149.01 155.61 41.04 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.3 m -140.31 23.56 2.35 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.241 1.417 . . . . 0.0 110.878 -170.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -140.46 125.1 10.91 Favored Pre-proline 0 C--O 1.236 0.356 0 C-N-CA 124.208 1.003 . . . . 0.0 108.865 179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -73.88 -34.31 5.4 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.322 2.015 . . . . 0.0 113.924 -169.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.308 2.3 pp0? -76.11 -27.3 57.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.945 -1.097 . . . . 0.0 110.304 179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -67.54 -45.29 76.1 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.357 0.98 . . . . 0.0 109.501 169.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 15.5 t -54.21 -56.52 9.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.58 -33.47 63.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.237 0.926 . . . . 0.0 110.656 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.01 -50.31 74.24 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.334 0.97 . . . . 0.0 109.824 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 mpp_? -69.07 -30.92 69.35 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.996 1.271 . . . . 0.0 112.462 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.65 -43.92 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.661 1.119 . . . . 0.0 109.742 171.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -71.66 -31.08 66.43 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.095 0.558 . . . . 0.0 111.884 178.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.6 tp -68.76 -33.96 74.78 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 125.696 1.598 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 63.5 mtt85 . . . . . 0 C--O 1.249 1.052 0 O-C-N 123.383 0.427 . . . . 0.0 110.405 173.547 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 tpt . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -63.92 -42.72 97.31 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.066 0.547 . . . . 0.0 111.406 -172.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.06 150.02 26.79 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.733 1.613 . . . . 0.0 106.949 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -65.58 -8.91 22.44 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -177.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.6 mt -130.0 38.26 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.766 1.226 . . . . 0.0 108.859 173.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 68.9 tp -57.34 -31.65 65.93 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.368 -0.832 . . . . 0.0 109.53 169.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -127.69 151.37 75.23 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.951 2.1 . . . . 0.0 105.407 169.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -62.4 132.17 37.2 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.788 2.326 . . . . 0.0 110.692 -171.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.6 p -70.13 -24.17 63.13 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.854 1.262 . . . . 0.0 112.402 -174.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -152.55 -179.83 7.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 126.513 1.925 . . . . 0.0 108.785 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 52.3 m-85 -45.45 126.15 6.32 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.672 1.589 . . . . 0.0 111.69 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 p -69.01 -37.52 78.73 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.4 m -139.82 157.56 26.39 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 N-CA-C 107.748 -1.205 . . . . 0.0 107.748 174.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -121.94 -28.83 4.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 124.589 1.155 . . . . 0.0 111.058 -172.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -158.04 163.94 37.21 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.704 1.138 . . . . 0.0 110.689 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 65.8 mt -135.06 135.16 52.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.2 mt -133.91 149.31 51.29 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 41.9 mt -137.92 116.72 14.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 103.592 -2.744 . . . . 0.0 103.592 169.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.8 mt -124.44 145.38 49.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.08 169.03 7.45 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.304 0.574 . . . . 0.0 110.305 169.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.78 -13.77 1.93 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -178.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -112.99 5.9 17.46 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.649 1.18 . . . . 0.0 110.844 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.99 7.27 59.85 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 125.021 1.296 . . . . 0.0 112.666 173.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.44 131.69 45.16 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 119.252 1.526 . . . . 0.0 109.738 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 66.8 mtt180 -58.21 127.49 32.37 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.9 mt -107.84 -40.16 5.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 161.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -148.08 153.11 38.46 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 123.382 0.673 . . . . 0.0 109.713 170.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -157.5 145.9 19.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 124.208 1.003 . . . . 0.0 108.449 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -144.98 139.15 27.3 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.873 1.669 . . . . 0.0 106.77 176.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -128.63 151.02 49.96 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.928 1.291 . . . . 0.0 108.18 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -134.04 22.3 3.82 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.698 1.999 . . . . 0.0 108.4 174.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.72 147.98 48.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.652 1.581 . . . . 0.0 111.39 -168.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -96.73 -6.87 35.33 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.521 1.528 . . . . 0.0 111.953 -176.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.5 m -70.68 -38.22 73.72 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.31 -0.869 . . . . 0.0 109.649 172.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -136.41 67.59 60.32 Favored Pre-proline 0 CA--C 1.544 0.75 0 C-N-CA 125.029 1.332 . . . . 0.0 110.57 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -87.77 -1.33 7.34 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.768 2.312 . . . . 0.0 113.645 -176.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.8 m -135.23 141.0 45.71 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 119.065 0.848 . . . . 0.0 110.22 -169.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.1 t -46.03 -50.03 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 126.422 1.889 . . . . 0.0 112.736 -169.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -55.83 -47.29 77.46 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.144 0.429 . . . . 0.0 111.304 -175.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -79.27 -32.42 43.67 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 110.341 -0.244 . . . . 0.0 110.341 -177.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.34 -50.83 72.04 Favored 'General case' 0 C--O 1.227 -0.084 0 C-N-CA 123.439 0.696 . . . . 0.0 110.624 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -62.7 -31.84 72.82 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.972 0.806 . . . . 0.0 111.132 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.95 72.15 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 121.914 -0.491 . . . . 0.0 110.007 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -60.91 -42.96 99.08 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.24 0.616 . . . . 0.0 110.223 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.14 -42.7 91.28 Favored 'General case' 0 C--N 1.334 -0.092 0 C-N-CA 126.562 1.945 . . . . 0.0 112.063 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -59.72 -43.32 94.22 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 118.996 0.816 . . . . 0.0 109.594 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.93 -45.01 91.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 118.055 -0.974 . . . . 0.0 111.627 172.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.25 -55.55 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -58.61 -45.51 89.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.897 0.879 . . . . 0.0 110.702 -174.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -54.57 -45.52 73.54 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.267 1.027 . . . . 0.0 111.453 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 62' ' ' LEU . 15.7 mmmt -70.83 -49.58 44.82 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 119.065 -0.493 . . . . 0.0 110.348 -179.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 37.2 p -67.62 -31.3 71.23 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.54 1.064 . . . . 0.0 111.398 -173.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -59.27 -23.89 62.77 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.606 0.762 . . . . 0.0 111.304 172.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -120.71 36.06 4.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.315 1.446 . . . . 0.0 109.797 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 44.9 m -127.98 158.17 38.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.822 1.649 . . . . 0.0 106.581 170.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.75 -59.61 3.41 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.741 -0.6 . . . . 0.0 111.037 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 55.0 m 177.57 -169.47 0.08 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.73 3.212 . . . . 0.0 107.286 176.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.322 10.4 pt-20 60.8 -47.91 0.11 Allowed 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 131.203 3.801 . . . . 0.0 117.196 169.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.3 tt -158.41 152.72 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 121.024 1.738 . . . . 0.0 110.915 -177.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -142.63 173.89 11.13 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.57 1.948 . . . . 0.0 108.775 170.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.3 tp -137.09 115.05 11.46 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 105.077 -2.194 . . . . 0.0 105.077 -176.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.406 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 1.5 mm? -75.62 -72.82 0.29 Allowed 'General case' 0 N--CA 1.457 -0.094 0 O-C-N 123.264 0.353 . . . . 0.0 110.138 -172.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -144.97 6.39 1.17 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.343 1.857 . . . . 0.0 110.881 -175.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 149.02 -40.27 0.9 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 126.086 1.803 . . . . 0.0 108.98 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.2 mt -68.61 142.93 55.0 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 86.9 m -107.86 146.44 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.9 p -139.67 118.77 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 28.3 m -86.41 150.05 3.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 106.282 -1.748 . . . . 0.0 106.282 169.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -153.73 166.09 33.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.582 0.706 . . . . 0.0 111.39 175.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.506 ' HE3' ' CE1' ' A' ' 98' ' ' PHE . 37.6 tttp -152.17 156.93 40.77 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.896 1.679 . . . . 0.0 106.758 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 m -136.13 135.53 39.33 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 176.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m -142.07 142.74 32.86 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.626 0.77 . . . . 0.0 109.382 175.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 mp 53.71 -85.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.156 2.182 . . . . 0.0 111.898 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -150.14 31.93 0.68 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.41 1.884 . . . . 0.0 108.806 -176.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.7 tp -140.38 145.21 36.81 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.494 1.918 . . . . 0.0 108.571 -169.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -127.79 140.25 52.16 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.679 1.192 . . . . 0.0 107.803 -179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -123.68 141.48 51.98 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.675 1.59 . . . . 0.0 107.47 -176.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -146.9 152.31 38.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 119.013 0.824 . . . . 0.0 110.524 -175.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 63.5 t -141.06 122.61 14.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 N-CA-C 105.801 -1.925 . . . . 0.0 105.801 169.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -99.19 142.11 15.52 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 106.083 -1.821 . . . . 0.0 106.083 176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -161.64 174.82 38.21 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-O 121.892 0.718 . . . . 0.0 112.4 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.31 176.5 3.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.148 1.379 . . . . 0.0 109.74 173.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 5.0 p -152.34 72.9 1.01 Allowed 'General case' 0 CA--C 1.532 0.287 0 O-C-N 121.377 -0.827 . . . . 0.0 109.383 172.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -54.94 -43.98 73.88 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.553 0.741 . . . . 0.0 111.037 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -145.17 -12.58 0.54 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.781 1.232 . . . . 0.0 112.173 172.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -156.52 175.69 13.7 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 124.565 1.146 . . . . 0.0 109.89 -170.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.56 4.36 4.64 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.872 2.469 . . . . 0.0 110.585 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -66.2 -32.35 73.73 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 120.869 -1.144 . . . . 0.0 110.663 -173.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -32.46 72.31 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.999 0.818 . . . . 0.0 111.682 175.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.2 mp -64.89 -50.05 68.07 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 172.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 1.3 mmt -55.64 -41.24 73.28 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.538 0.335 . . . . 0.0 110.295 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.14 75.72 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.587 0.755 . . . . 0.0 110.287 -179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 45.1 t -60.91 -44.78 98.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 119.027 0.83 . . . . 0.0 110.07 -179.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.1 tp -60.82 -50.76 72.14 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.344 0.52 . . . . 0.0 110.616 179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -64.24 -40.29 95.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 119.581 -0.247 . . . . 0.0 110.484 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.07 -45.56 93.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.474 0.71 . . . . 0.0 109.574 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 tp -65.08 -49.63 69.3 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.786 0.721 . . . . 0.0 111.114 178.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.506 ' CE1' ' HE3' ' A' ' 70' ' ' LYS . 68.5 t80 -60.93 -43.81 98.11 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.376 0.608 . . . . 0.0 110.88 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.59 -28.81 37.0 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.322 -0.861 . . . . 0.0 111.969 -174.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 23.3 p -66.72 -45.88 77.26 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 119.905 1.23 . . . . 0.0 110.01 172.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 47.1 mt -51.13 -49.43 60.81 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 170.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 m -58.85 -32.32 69.33 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 118.159 -0.924 . . . . 0.0 113.262 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -76.36 -50.64 13.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 120.603 1.547 . . . . 0.0 110.659 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptt? -79.78 -32.21 40.88 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 119.357 -0.937 . . . . 0.0 112.95 -169.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.503 HD21 ' HB1' ' A' ' 113' ' ' ALA . 18.3 tp -82.37 -32.54 29.19 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 118.058 0.39 . . . . 0.0 111.9 -170.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 46.36 47.79 13.69 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.083 1.353 . . . . 0.0 112.275 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -138.08 174.97 10.0 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.928 2.091 . . . . 0.0 105.903 169.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -72.25 15.32 0.17 Allowed 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -178.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . 0.28 24.0 m 44.06 41.7 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 127.148 2.179 . . . . 0.0 111.734 -173.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.6 170.57 15.51 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.205 1.002 . . . . 0.0 110.841 175.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -53.96 -42.09 68.52 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.476 0.71 . . . . 0.0 112.798 -176.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.7 tpp85 -66.57 -42.17 87.44 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-O 118.887 -0.578 . . . . 0.0 110.073 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.503 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -64.38 -39.03 93.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.899 0.772 . . . . 0.0 110.388 -179.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.03 -50.97 71.6 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 123.614 0.766 . . . . 0.0 110.089 171.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.9 tp -58.0 -37.88 75.1 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.51 0.724 . . . . 0.0 111.684 178.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -67.61 -21.88 65.38 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.838 0.855 . . . . 0.0 112.864 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.43 24.6 4.8 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.259 0.936 . . . . 0.0 113.12 -171.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -41.7 -45.33 3.44 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.197 1.399 . . . . 0.0 112.351 177.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -66.24 -38.2 87.33 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.427 1.012 . . . . 0.0 112.275 -178.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.84 -40.55 93.68 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 110.501 -1.04 . . . . 0.0 110.501 175.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.27 -48.91 77.67 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.139 0.976 . . . . 0.0 110.242 170.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -57.74 -46.56 84.29 Favored 'General case' 0 N--CA 1.462 0.145 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 59.9 mt -65.62 -38.88 90.68 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-O 118.477 -0.773 . . . . 0.0 111.472 -179.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -61.97 -48.73 79.07 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-N 119.039 0.836 . . . . 0.0 109.631 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 41.0 t -56.72 -46.78 83.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 123.201 0.6 . . . . 0.0 109.458 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -68.71 -0.53 5.42 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.273 1.429 . . . . 0.0 113.56 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -120.64 -15.65 8.41 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.534 1.533 . . . . 0.0 111.34 175.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 65.7 mt -82.36 -37.04 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 124.306 1.043 . . . . 0.0 109.009 169.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.7 p -152.07 153.51 9.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.27 0.941 . . . . 0.0 110.384 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -150.54 136.94 18.76 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.307 1.443 . . . . 0.0 107.248 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 54.75 29.74 50.41 Favored Glycine 0 CA--C 1.533 1.189 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.488 178.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 73.46 18.34 79.34 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-N 118.067 0.933 . . . . 0.0 113.7 179.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 41.4 t -126.47 133.03 69.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 174.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 13.5 pt -60.2 156.87 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.74 0.781 . . . . 0.0 111.422 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 82.0 mt -120.23 -22.24 6.66 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 126.291 1.836 . . . . 0.0 110.271 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -154.85 160.61 41.34 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 119.036 0.835 . . . . 0.0 109.973 -177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 8.4 m -135.52 14.04 3.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.998 1.319 . . . . 0.0 112.205 -169.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.79 123.29 10.61 Favored Pre-proline 0 N--CA 1.465 0.277 0 C-N-CA 123.72 0.808 . . . . 0.0 110.09 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.7 -44.63 13.12 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.728 2.286 . . . . 0.0 112.941 -170.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . 0.299 2.1 pp0? -73.92 -26.94 60.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 119.292 -0.963 . . . . 0.0 111.07 -175.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -70.05 -35.2 74.08 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 120.547 1.521 . . . . 0.0 110.539 169.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.3 t -58.7 -43.27 87.33 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.17 0 CA-C-N 119.575 1.079 . . . . 0.0 109.24 169.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.43 -39.47 84.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.844 1.202 . . . . 0.0 111.028 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -61.04 -45.5 94.51 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 119.904 1.229 . . . . 0.0 110.155 175.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -59.04 -47.79 83.96 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.855 -0.528 . . . . 0.0 110.017 177.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 62.6 t -59.5 -41.93 86.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.496 0.718 . . . . 0.0 109.912 179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.05 -34.86 77.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.186 0.595 . . . . 0.0 111.782 -178.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.33 -32.32 58.63 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.944 0.898 . . . . 0.0 111.929 177.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.838 178.834 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.483 1.206 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -139.51 171.09 14.76 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.233 1.413 . . . . 0.0 108.031 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -151.15 164.08 37.34 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.196 1.398 . . . . 0.0 108.977 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.8 tp -59.15 -33.21 70.63 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.882 0.873 . . . . 0.0 111.722 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 12.4 mt -131.55 56.43 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.78 132.84 55.15 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.507 0.723 . . . . 0.0 109.168 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 20.83 69.12 0.27 Allowed Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 129.066 2.946 . . . . 0.0 114.565 174.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -72.66 162.13 42.09 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 123.417 2.745 . . . . 0.0 111.167 -177.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.2 m -74.78 20.38 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.05 1.34 . . . . 0.0 112.232 171.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.43 133.74 47.15 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.845 1.258 . . . . 0.0 108.909 -176.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -125.63 131.42 52.66 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 169.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 m -54.06 -40.34 67.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.532 1.133 . . . . 0.0 111.267 -176.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.3 m -140.5 164.29 21.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.413 1.085 . . . . 0.0 108.692 175.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -122.8 -28.98 4.06 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 125.001 1.32 . . . . 0.0 110.191 176.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.75 166.9 27.9 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.753 1.16 . . . . 0.0 111.867 175.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -136.61 136.31 48.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -132.44 149.29 52.37 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 61.8 mt -139.1 120.39 15.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 104.175 -2.528 . . . . 0.0 104.175 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 76.8 mt -127.76 149.24 50.33 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -65.38 171.19 4.09 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 169.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.55 -17.06 62.42 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.795 0.838 . . . . 0.0 112.354 173.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.5 -9.48 59.4 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.298 1.039 . . . . 0.0 112.095 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.44 86.01 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 0.0 112.274 -171.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -74.56 143.22 44.57 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.461 1.131 . . . . 0.0 109.941 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -59.61 133.02 55.71 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 118.626 0.648 . . . . 0.0 110.21 177.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt -106.31 -38.6 6.18 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 151.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -151.63 154.33 36.2 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.792 0.837 . . . . 0.0 110.632 172.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 146.16 18.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.433 1.093 . . . . 0.0 108.585 169.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.99 144.26 30.94 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 125.699 1.6 . . . . 0.0 107.505 171.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -128.81 150.47 50.3 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.554 1.542 . . . . 0.0 107.513 176.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -135.14 -0.86 2.7 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.816 0.846 . . . . 0.0 111.984 -174.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -135.02 160.2 39.07 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.885 0.766 . . . . 0.0 110.125 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -72.06 3.39 4.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.71 2.004 . . . . 0.0 113.194 -170.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.1 p -62.45 -49.04 77.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.414 1.085 . . . . 0.0 110.752 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -142.86 69.3 19.09 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.222 1.009 . . . . 0.0 109.537 -175.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -85.74 -2.37 9.0 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.698 2.265 . . . . 0.0 113.627 -173.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 40.1 m -135.9 141.92 44.63 Favored 'General case' 0 C--N 1.341 0.198 0 CA-C-N 119.278 0.945 . . . . 0.0 109.617 -169.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 38.4 t -44.52 -52.82 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 126.469 1.908 . . . . 0.0 113.137 -169.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -60.32 -45.0 94.96 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.624 0.647 . . . . 0.0 111.014 -175.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -69.98 -34.12 72.95 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -62.66 -51.5 67.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 118.625 -0.702 . . . . 0.0 109.857 174.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -57.97 -38.03 75.28 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.275 0.943 . . . . 0.0 111.496 -179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.17 -50.09 73.23 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.213 0.605 . . . . 0.0 109.609 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -63.52 -38.65 91.95 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.454 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -61.0 -45.09 96.22 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 126.444 1.898 . . . . 0.0 111.473 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.23 -40.03 93.52 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 121.546 -0.721 . . . . 0.0 110.035 176.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.476 HD21 HD13 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -57.03 -49.55 75.47 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 118.669 -0.681 . . . . 0.0 111.062 171.182 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 mm -54.85 -50.71 59.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 124.703 1.201 . . . . 0.0 108.71 179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -61.17 -49.32 77.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 122.67 0.388 . . . . 0.0 110.318 -176.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -57.4 -49.37 76.41 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.893 0.477 . . . . 0.0 111.1 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm -60.46 -52.44 65.21 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -177.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 33.0 p -71.87 -32.16 67.19 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 121.903 -0.498 . . . . 0.0 111.885 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -63.12 -15.12 55.69 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.515 -0.74 . . . . 0.0 111.443 171.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -120.85 25.52 9.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.185 1.794 . . . . 0.0 109.837 -176.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 94.8 m -131.42 158.1 41.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.169 1.788 . . . . 0.0 107.711 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.18 -42.11 99.32 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 118.442 -0.79 . . . . 0.0 112.879 -170.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.4 m 139.8 -177.71 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.805 1 C-N-CA 132.427 4.291 . . . . 0.0 108.878 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.324 10.2 pt-20 59.07 -44.03 0.07 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 131.226 3.81 . . . . 0.0 117.307 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.0 tt -150.23 155.48 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 120.61 1.55 . . . . 0.0 109.932 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -149.79 166.06 30.58 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 127.034 2.134 . . . . 0.0 108.541 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.66 115.71 14.96 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 104.331 -2.47 . . . . 0.0 104.331 171.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.476 HD13 HD21 ' A' ' 47' ' ' ASN . 1.5 pp -147.28 138.42 23.8 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 123.896 0.878 . . . . 0.0 109.565 -172.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 52.42 27.04 4.56 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.002 1.321 . . . . 0.0 112.196 -177.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.82 4.3 90.39 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.585 1.088 . . . . 0.0 113.525 -177.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.8 mt -108.74 138.85 44.39 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.453 1.501 . . . . 0.0 108.751 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 51.2 m -83.15 136.99 34.24 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 172.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 72.3 t -135.07 138.41 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -176.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 32.0 m -120.48 147.43 24.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 27.0 p90 -158.73 162.37 37.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.93 0.395 . . . . 0.0 110.958 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -149.71 175.83 11.23 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.457 1.103 . . . . 0.0 108.514 170.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.4 p -142.37 146.65 35.17 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 169.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -145.44 149.03 33.97 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.318 1.047 . . . . 0.0 109.115 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.6 mp 50.36 -90.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.151 1.781 . . . . 0.0 110.989 -172.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -148.55 36.71 0.81 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.411 1.884 . . . . 0.0 108.99 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 64.3 tp -134.14 145.21 49.06 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 127.24 2.216 . . . . 0.0 107.889 -169.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -125.02 144.98 50.12 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -133.96 141.21 47.2 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.126 1.37 . . . . 0.0 107.515 -173.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -145.46 147.52 32.28 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 123.958 0.903 . . . . 0.0 110.271 -171.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 82.0 t -134.77 137.32 51.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 105.329 -2.1 . . . . 0.0 105.329 169.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -127.98 133.86 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 105.117 -2.179 . . . . 0.0 105.117 -172.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -154.79 176.35 32.55 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-O 122.311 0.95 . . . . 0.0 112.695 -178.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.3 m -63.71 129.97 42.3 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 113.798 -1.201 . . . . 0.0 109.225 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -67.23 125.18 25.26 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 169.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -153.79 -175.57 5.43 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.003 0.921 . . . . 0.0 109.442 -169.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.8 -14.16 30.43 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.629 1.571 . . . . 0.0 112.789 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -144.47 159.24 43.08 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 124.264 1.026 . . . . 0.0 110.061 174.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.43 -4.16 7.82 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.056 2.542 . . . . 0.0 109.944 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.2 -31.73 71.49 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.941 1.296 . . . . 0.0 110.722 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.1 ptt? -64.92 -34.34 78.16 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.24 0.927 . . . . 0.0 111.664 173.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.1 mt -70.11 -46.67 64.35 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 4.0 mmt -55.61 -40.58 72.29 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.281 174.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.47 -49.13 74.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.066 0.946 . . . . 0.0 109.896 -178.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 54.5 t -61.94 -44.12 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-O 118.946 -0.55 . . . . 0.0 110.074 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.67 -46.89 87.8 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.907 0.776 . . . . 0.0 110.665 179.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -63.8 -45.17 90.88 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 119.04 -0.505 . . . . 0.0 110.22 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 90.9 m -60.45 -44.65 95.63 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.154 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.14 -55.72 29.1 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 118.615 0.643 . . . . 0.0 110.171 -179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -62.71 -43.95 97.47 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.899 0.38 . . . . 0.0 110.632 -173.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -71.7 -37.02 70.73 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 121.707 -0.621 . . . . 0.0 111.166 -177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 t -56.59 -52.38 65.06 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 124.159 0.984 . . . . 0.0 109.691 174.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 77.1 mt -53.77 -48.44 69.75 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.8 m -56.43 -35.58 68.0 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 118.613 -0.708 . . . . 0.0 112.332 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -74.59 -47.71 30.89 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-N 119.571 1.078 . . . . 0.0 111.233 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 10.2 ptp -69.35 -38.95 78.37 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -169.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . 0.327 2.7 pp -97.26 -5.24 37.24 Favored 'General case' 0 C--N 1.342 0.254 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 -174.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 49.82 30.3 3.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -147.07 179.03 7.9 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.814 1.646 . . . . 0.0 106.879 169.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.87 137.1 57.88 Favored 'General case' 0 C--O 1.23 0.078 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 31.5 m -76.31 45.89 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.318 1.847 . . . . 0.0 111.604 -174.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.3 170.15 7.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.84 0.856 . . . . 0.0 111.16 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -54.79 -42.28 71.59 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 121.829 -0.545 . . . . 0.0 112.117 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.6 tpp85 -65.81 -42.49 90.58 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 118.485 0.584 . . . . 0.0 109.64 178.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.23 81.56 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 118.286 0.494 . . . . 0.0 110.355 -177.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.298 0.0 OUTLIER -74.84 -28.59 60.75 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.073 0.851 . . . . 0.0 111.587 -179.255 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 65.8 tp -60.89 -39.65 90.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.768 1.167 . . . . 0.0 110.774 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -68.26 -14.1 62.74 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.519 0.727 . . . . 0.0 112.179 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -127.75 24.9 6.06 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.267 1.027 . . . . 0.0 111.64 -173.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 2.4 mmt -47.29 -45.76 24.43 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 124.405 1.082 . . . . 0.0 112.29 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.79 -43.53 96.06 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.05 0.841 . . . . 0.0 110.775 -178.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.48 -43.18 99.41 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 177.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.7 tp -56.47 -52.43 64.74 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.969 1.308 . . . . 0.0 109.993 174.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -59.11 -44.84 92.0 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.181 0.446 . . . . 0.0 109.879 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.09 -37.59 86.16 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.804 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.19 91.91 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.981 0.81 . . . . 0.0 110.463 175.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 48.6 t -54.68 -49.04 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -71.6 2.7 4.79 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.016 1.326 . . . . 0.0 113.631 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -119.09 -17.04 9.06 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.533 1.533 . . . . 0.0 111.305 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 63.2 mt -84.33 -46.3 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 172.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.25 154.36 30.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.406 1.082 . . . . 0.0 110.8 -174.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -147.3 137.86 23.43 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 125.926 1.69 . . . . 0.0 107.257 169.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.89 25.48 52.9 Favored Glycine 0 CA--C 1.534 1.262 0 CA-C-O 119.558 -0.579 . . . . 0.0 113.615 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 78.43 18.09 76.6 Favored Glycine 0 CA--C 1.531 1.051 0 CA-C-N 118.149 0.974 . . . . 0.0 113.363 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 46.6 t -131.8 139.47 50.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 119.343 1.572 . . . . 0.0 107.043 -177.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 18.4 pt -64.07 150.08 10.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 O-C-N 122.147 -0.346 . . . . 0.0 110.667 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 pp -132.79 -14.51 2.77 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.2 1.0 . . . . 0.0 111.928 174.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -149.54 154.07 38.16 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 169.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.4 m -137.12 26.66 2.94 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.561 1.144 . . . . 0.0 110.906 -169.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -143.07 125.74 8.9 Favored Pre-proline 0 C--O 1.235 0.292 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.42 -33.9 10.34 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.295 1.996 . . . . 0.0 111.643 -169.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.86 -40.36 79.38 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -178.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -68.27 -39.84 82.05 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.542 0.61 . . . . 0.0 109.795 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.9 t -55.58 -52.9 42.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 118.741 0.701 . . . . 0.0 109.47 173.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.59 -40.48 84.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 119.499 1.045 . . . . 0.0 110.11 -179.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -63.02 -40.21 97.08 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 119.032 0.833 . . . . 0.0 111.044 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 65.6 mtp85 -68.57 -42.32 78.48 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.506 -0.746 . . . . 0.0 110.281 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 53.2 t -57.51 -43.22 82.56 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 118.595 0.634 . . . . 0.0 109.409 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -69.1 -33.58 73.74 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.409 0.684 . . . . 0.0 111.914 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 31.3 mt -72.26 -31.3 65.65 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.197 0.999 . . . . 0.0 112.137 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.967 176.539 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -150.86 170.01 20.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.987 1.315 . . . . 0.0 108.741 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.25 164.56 38.63 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 125.855 1.662 . . . . 0.0 108.042 177.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 66.0 tp -53.94 -36.49 62.87 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 111.857 179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.2 pt -128.29 50.5 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 126.565 1.946 . . . . 0.0 108.457 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -54.11 -30.66 49.47 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 121.751 -0.593 . . . . 0.0 109.861 169.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -141.46 147.73 47.57 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 129.76 3.224 . . . . 0.0 103.06 168.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.84 84.48 0.67 Allowed 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 123.348 2.698 . . . . 0.0 109.55 178.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.4 m -78.96 1.61 23.14 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.222 1.409 . . . . 0.0 112.368 -170.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -149.14 165.11 32.75 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.299 2.239 . . . . 0.0 108.044 175.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -60.71 135.29 57.72 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 122.764 0.426 . . . . 0.0 110.103 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 34.3 p -80.66 -44.02 19.49 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 p -122.27 121.57 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.745 1.218 . . . . 0.0 108.037 -169.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.465 ' H ' ' HA2' ' A' ' 81' ' ' GLY . 68.0 mmtt -75.06 -42.16 57.51 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 123.655 0.782 . . . . 0.0 109.362 174.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.28 165.72 23.92 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.233 0.47 . . . . 0.0 111.196 -171.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.27 131.27 51.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.9 mt -130.41 148.16 52.19 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mt -138.54 118.84 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 104.124 -2.547 . . . . 0.0 104.124 173.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 67.7 mt -122.68 143.04 50.04 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -175.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.41 167.79 13.96 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 169.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -57.29 -22.03 38.94 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -90.67 -25.5 20.05 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.727 1.149 . . . . 0.0 111.305 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 125.81 6.97 5.79 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 126.046 1.784 . . . . 0.0 112.557 173.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.29 129.48 40.02 Favored 'General case' 0 C--N 1.338 0.075 0 CA-C-N 119.088 1.444 . . . . 0.0 109.789 -178.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttt180 -66.32 94.59 0.27 Allowed 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 109.288 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.73 -50.87 61.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 168.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -148.78 153.09 37.66 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -156.87 147.55 21.58 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 169.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.7 OUTLIER -143.51 147.89 35.17 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 125.077 1.351 . . . . 0.0 107.504 169.913 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -137.73 143.76 41.36 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.91 1.684 . . . . 0.0 106.482 -175.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.06 -2.99 5.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.262 1.025 . . . . 0.0 112.621 -173.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -131.04 162.71 29.21 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.842 0.746 . . . . 0.0 109.08 -177.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -71.72 7.27 1.56 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.833 2.053 . . . . 0.0 112.505 -175.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.9 p -61.68 -52.7 63.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.46 1.504 . . . . 0.0 110.207 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -144.29 70.75 16.12 Favored Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 124.64 1.176 . . . . 0.0 109.039 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -85.02 -1.62 9.43 Favored 'Trans proline' 0 CA--C 1.542 0.876 0 C-N-CA 122.667 2.245 . . . . 0.0 113.69 -172.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 m -136.49 139.38 42.26 Favored 'General case' 0 C--N 1.34 0.174 0 C-N-CA 123.971 0.908 . . . . 0.0 109.773 -169.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.5 t -46.42 -49.1 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 126.066 1.746 . . . . 0.0 113.025 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -58.47 -43.31 88.85 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.722 0.692 . . . . 0.0 111.406 -176.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -76.14 -32.18 58.98 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.856 0.298 . . . . 0.0 110.299 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -62.48 -48.73 78.32 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.252 0.621 . . . . 0.0 110.231 175.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -59.79 -35.71 75.23 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 118.983 0.811 . . . . 0.0 111.178 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.05 -44.86 75.43 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 123.02 0.528 . . . . 0.0 109.961 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -62.77 -38.35 90.24 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.077 0.551 . . . . 0.0 111.005 176.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.75 -41.25 96.06 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.701 1.6 . . . . 0.0 110.872 177.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.3 mmtt -60.34 -45.9 91.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.708 -0.62 . . . . 0.0 109.769 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.2 -48.12 77.04 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.431 0.692 . . . . 0.0 111.176 174.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mm -56.68 -54.07 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 C-N-CA 124.41 1.084 . . . . 0.0 108.546 -179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -60.28 -48.99 79.37 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.174 0.59 . . . . 0.0 109.926 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -60.37 -39.66 88.02 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 124.517 1.127 . . . . 0.0 112.692 -179.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt -73.37 -50.04 24.04 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 121.645 -0.659 . . . . 0.0 109.344 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.404 ' HB ' ' CE2' ' A' ' 69' ' ' TYR . 33.1 p -70.39 -31.87 69.28 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -169.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -69.11 -5.37 21.77 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.938 0.79 . . . . 0.0 112.527 173.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.3 mtp-105 -126.78 28.27 5.89 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.388 1.875 . . . . 0.0 109.353 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.495 HG21 ' HB2' ' A' ' 60' ' ' ALA . 99.4 m -134.47 158.17 44.59 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.913 1.685 . . . . 0.0 108.048 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 29.05 0.46 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.542 1.537 . . . . 0.0 113.324 -169.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m 67.81 -179.53 0.22 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.016 1.726 . . . . 0.0 113.319 177.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.317 10.7 pt-20 56.62 -43.34 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 131.362 3.865 . . . . 0.0 117.006 -176.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 17.6 tt -154.89 155.25 6.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 120.21 1.368 . . . . 0.0 109.772 -179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.495 ' HB2' HG21 ' A' ' 55' ' ' THR . . . -148.5 172.69 14.08 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.487 1.915 . . . . 0.0 108.389 172.087 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.7 tt -134.43 121.24 20.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 103.64 -2.726 . . . . 0.0 103.64 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 52.2 mt -78.14 -69.08 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.062 -168.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -142.53 7.9 1.74 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.548 1.939 . . . . 0.0 110.281 -176.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 148.82 -43.73 0.78 Allowed Glycine 0 CA--C 1.525 0.662 0 C-N-CA 126.241 1.877 . . . . 0.0 108.703 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.6 mt -68.49 129.31 39.56 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.826 0.85 . . . . 0.0 109.889 174.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 85.3 m -78.76 148.13 33.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 169.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.4 p -140.13 130.9 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 171.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -101.3 144.8 12.48 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 169.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CE2' ' HB ' ' A' ' 52' ' ' THR . 25.7 p90 -160.11 162.16 33.97 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 118.004 0.366 . . . . 0.0 111.61 -175.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -154.46 -179.85 8.34 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 169.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 9.7 p -135.26 149.24 49.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 123.885 0.874 . . . . 0.0 109.094 170.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 m -146.44 142.2 27.9 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.3 mt 61.68 -84.57 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 126.703 2.001 . . . . 0.0 110.85 174.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -148.99 25.77 0.91 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.236 2.614 . . . . 0.0 109.737 -176.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.27 150.48 51.49 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 127.194 2.198 . . . . 0.0 109.581 -169.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -130.35 143.62 50.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.53 1.532 . . . . 0.0 107.582 170.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -135.89 137.42 41.41 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 124.801 1.24 . . . . 0.0 107.669 -170.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -144.08 144.6 31.69 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 -171.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 62.0 t -135.74 121.79 31.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 105.689 -1.967 . . . . 0.0 105.689 170.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.39 134.29 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 -173.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.465 ' HA2' ' H ' ' A' ' 14' ' ' LYS . . . -149.42 172.39 29.44 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-O 122.005 0.781 . . . . 0.0 113.325 -174.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 15.5 m -64.72 164.16 12.65 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.466 -1.367 . . . . 0.0 109.277 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.9 m -129.01 29.12 5.24 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.915 0.886 . . . . 0.0 110.752 -169.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 38.8 p90 -61.69 -34.56 75.96 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.873 -169.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -160.72 -33.31 0.05 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.484 0.584 . . . . 0.0 112.418 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.24 171.77 14.45 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.693 0.797 . . . . 0.0 111.487 -170.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.1 -2.5 2.86 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 127.888 2.475 . . . . 0.0 110.69 -174.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.3 mt -66.16 -33.61 76.17 Favored 'General case' 0 CA--C 1.523 -0.076 0 C-N-CA 124.266 1.026 . . . . 0.0 110.714 -173.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -32.49 74.08 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.643 0.656 . . . . 0.0 111.253 173.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.8 mt -70.25 -43.64 70.11 Favored 'General case' 0 C--O 1.23 0.067 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.8 mmt -55.82 -40.89 73.41 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.064 173.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.97 -47.87 78.7 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.121 0.568 . . . . 0.0 110.468 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 64.5 t -60.25 -46.92 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 118.877 -0.582 . . . . 0.0 109.696 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 60.4 tp -60.07 -45.65 92.2 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.575 0.625 . . . . 0.0 110.514 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -63.24 -47.08 83.98 Favored 'General case' 0 C--N 1.338 0.094 0 CA-C-O 119.146 -0.455 . . . . 0.0 110.237 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 97.7 m -61.55 -44.66 96.63 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.192 0.451 . . . . 0.0 110.389 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.6 tp -60.5 -53.57 55.88 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.887 0.875 . . . . 0.0 110.791 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -63.82 -41.41 97.86 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.684 0.278 . . . . 0.0 110.908 -177.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -75.03 -31.81 61.42 Favored 'General case' 0 N--CA 1.456 -0.141 0 O-C-N 121.51 -0.744 . . . . 0.0 111.294 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -62.67 -47.75 82.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.916 0.78 . . . . 0.0 110.023 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 49.5 mt -51.7 -51.42 56.16 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -34.12 69.77 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -71.67 -41.55 68.56 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 119.645 1.111 . . . . 0.0 111.437 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -97.85 3.36 49.85 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -171.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 17.8 tp -141.32 58.19 1.52 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.208 1.803 . . . . 0.0 107.902 -172.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -69.54 49.83 0.09 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.49 2.316 . . . . 0.0 112.9 -171.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.7 pttt -137.55 -67.86 0.48 Allowed 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.848 1.259 . . . . 0.0 109.318 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -159.45 149.19 18.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 174.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.5 m -90.91 50.42 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-O 121.809 0.814 . . . . 0.0 109.71 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -94.95 167.9 11.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.872 1.269 . . . . 0.0 111.275 -177.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -49.15 -54.66 15.33 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.155 1.382 . . . . 0.0 112.743 -171.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 22.0 tpt180 -62.04 -42.64 99.4 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 122.462 0.305 . . . . 0.0 110.499 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -66.49 -38.58 87.56 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.388 0.54 . . . . 0.0 110.582 -177.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 5.1 mp -62.79 -45.37 92.96 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 121.421 -0.799 . . . . 0.0 110.207 174.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 68.6 tp -57.28 -38.25 73.64 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.288 0.635 . . . . 0.0 111.322 176.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -71.5 -16.99 62.37 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.92 23.54 4.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.404 1.002 . . . . 0.0 112.685 -175.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 1.1 mmt -37.41 -50.09 1.05 Allowed 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.334 1.854 . . . . 0.0 113.179 175.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -62.12 -40.3 95.44 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.539 1.063 . . . . 0.0 111.377 -177.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -62.76 -45.86 94.86 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.097 -1.201 . . . . 0.0 110.097 177.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.75 -51.08 71.48 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.021 0.928 . . . . 0.0 110.747 175.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -54.43 -48.39 71.73 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 109.6 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 90.6 mt -72.78 -33.31 66.22 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 118.629 -0.7 . . . . 0.0 111.434 -175.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.84 -44.48 96.02 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 119.37 0.987 . . . . 0.0 109.843 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 38.3 t -58.04 -45.77 88.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.448 0.567 . . . . 0.0 109.482 175.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -3.02 6.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.687 1.195 . . . . 0.0 113.506 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -115.29 -17.97 11.19 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.222 1.409 . . . . 0.0 111.745 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 55.6 mt -86.1 -30.35 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.265 1.026 . . . . 0.0 109.179 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 61.6 t -139.97 147.59 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 125.245 1.418 . . . . 0.0 107.938 -170.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -143.31 130.84 21.16 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.86 1.264 . . . . 0.0 107.646 170.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.9 52.1 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.538 175.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 74.01 16.45 79.5 Favored Glycine 0 CA--C 1.527 0.833 0 CA-C-N 118.225 1.012 . . . . 0.0 113.684 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 57.4 t -127.87 142.32 44.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 106.765 -1.568 . . . . 0.0 106.765 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 44.2 pt -54.53 142.9 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 121.526 0.679 . . . . 0.0 110.562 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.53 -42.3 2.77 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.996 1.718 . . . . 0.0 108.317 -175.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -144.86 156.42 44.0 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.135 0.974 . . . . 0.0 108.716 -176.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.2 m -135.29 24.92 3.51 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.152 1.381 . . . . 0.0 110.49 -172.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -141.84 118.1 7.18 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 124.377 1.071 . . . . 0.0 108.87 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.7 -32.57 11.59 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.701 2.267 . . . . 0.0 111.79 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.19 -40.44 86.51 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 5.2 mm-40 -69.63 -36.55 76.24 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.816 0.735 . . . . 0.0 110.298 177.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 18.7 t -56.78 -55.68 18.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 123.236 0.614 . . . . 0.0 109.396 175.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 34.1 m -67.18 -30.14 48.32 Favored 'Isoleucine or valine' 0 C--N 1.34 0.176 0 CA-C-N 119.2 0.909 . . . . 0.0 111.287 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.54 -51.88 67.56 Favored 'General case' 0 C--N 1.341 0.234 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.017 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -62.53 -40.77 97.83 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.73 1.15 . . . . 0.0 110.844 178.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 6.3 t -56.66 -45.93 82.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 CA-C-N 118.104 0.411 . . . . 0.0 110.384 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -79.62 -26.52 41.15 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.026 0.83 . . . . 0.0 111.452 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 63.7 tp -71.88 -22.29 61.53 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.396 1.879 . . . . 0.0 112.1 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 22.0 ptt-85 . . . . . 0 C--O 1.248 1.012 0 C-N-CA 125.083 1.353 . . . . 0.0 113.167 178.632 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -159.83 -177.81 6.61 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.046 1.738 . . . . 0.0 108.032 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -146.42 167.49 23.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.22 1.408 . . . . 0.0 109.153 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 44.1 tp -62.02 -27.03 68.59 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.536 0.734 . . . . 0.0 111.94 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.2 mt -127.73 54.92 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.8 -1.926 . . . . 0.0 105.8 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -54.11 -36.42 63.2 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.932 0.893 . . . . 0.0 109.808 174.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -134.19 141.36 39.11 Favored Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 169.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.42 -4.08 13.09 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.795 2.997 . . . . 0.0 112.881 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.0 m -53.7 -27.7 29.58 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.327 1.451 . . . . 0.0 112.243 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 26.13 81.61 0.01 OUTLIER 'General case' 0 C--N 1.348 0.503 0 C-N-CA 129.085 2.954 . . . . 0.0 113.002 173.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -63.55 115.16 4.42 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 39.7 p -66.85 -26.83 67.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 122.935 0.494 . . . . 0.0 109.993 179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 15.4 m -135.6 141.1 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 107.745 -1.205 . . . . 0.0 107.745 173.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -100.06 -27.34 13.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 117.682 -1.152 . . . . 0.0 109.723 173.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.27 166.09 28.19 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.56 1.073 . . . . 0.0 111.916 176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.9 mt -134.01 137.19 52.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 104.666 -2.346 . . . . 0.0 104.666 170.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.1 mt -134.11 150.79 51.16 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.405 HG22 HD11 ' A' ' 75' ' ' LEU . 61.0 mt -137.69 114.35 11.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 102.925 -2.991 . . . . 0.0 102.925 169.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 46.2 mt -117.29 147.78 42.27 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 122.238 1.018 . . . . 0.0 110.164 -169.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -68.85 172.55 6.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 113.449 -1.705 . . . . 0.0 107.928 169.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -78.08 35.6 0.21 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.05 2.14 . . . . 0.0 111.126 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -149.09 8.1 0.73 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.696 2.398 . . . . 0.0 110.838 178.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.11 47.91 69.29 Favored Glycine 0 C--N 1.342 0.872 0 O-C-N 120.883 -1.136 . . . . 0.0 110.767 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -123.97 126.7 46.77 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 118.013 0.906 . . . . 0.0 108.846 -178.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -60.61 107.98 0.76 Allowed 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 123.78 0.832 . . . . 0.0 110.888 -177.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt -74.12 -41.59 61.37 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 155.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -141.14 149.1 41.09 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.081 1.352 . . . . 0.0 108.208 171.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.55 144.02 16.55 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 29' ' ' LYS . 0.5 OUTLIER -148.23 147.63 29.59 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.013 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -135.49 149.11 49.44 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.624 1.57 . . . . 0.0 106.978 -176.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -133.54 -1.36 3.14 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.974 0.91 . . . . 0.0 111.92 -174.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -135.05 159.4 41.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.927 0.785 . . . . 0.0 110.036 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -73.53 2.28 8.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.021 2.129 . . . . 0.0 113.043 -169.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 p -59.64 -47.54 85.22 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.337 1.055 . . . . 0.0 110.724 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -144.87 79.38 12.11 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 124.53 1.132 . . . . 0.0 108.261 -177.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -92.67 -0.6 3.84 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.864 2.376 . . . . 0.0 113.504 -174.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.7 m -134.31 138.05 44.67 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 124.131 0.972 . . . . 0.0 109.814 -169.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -49.24 -44.85 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 125.257 1.423 . . . . 0.0 113.532 -169.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 mtpt -61.14 -44.62 97.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 117.959 0.345 . . . . 0.0 110.646 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -78.9 -32.51 45.78 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -61.66 -50.1 73.86 Favored 'General case' 0 C--O 1.226 -0.168 0 CA-C-N 118.355 0.525 . . . . 0.0 110.455 175.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -62.39 -33.46 74.8 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.064 -1.023 . . . . 0.0 111.153 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.21 -46.5 73.69 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.946 -0.471 . . . . 0.0 109.866 175.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.17 -37.96 81.77 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.657 0.783 . . . . 0.0 110.699 175.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -63.33 -42.81 98.99 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.793 1.637 . . . . 0.0 110.997 176.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 mmtt -61.36 -44.65 96.81 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.164 0.893 . . . . 0.0 110.447 172.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.489 HD21 HD23 ' A' ' 62' ' ' LEU . 0.3 OUTLIER -58.15 -45.48 87.34 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.077 0.551 . . . . 0.0 111.198 177.28 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.1 mm -58.28 -53.91 39.85 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.377 1.071 . . . . 0.0 108.394 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.19 -43.74 95.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.73 0.412 . . . . 0.0 110.813 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -56.03 -48.24 76.33 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 123.347 0.659 . . . . 0.0 110.641 174.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -61.67 -50.66 71.6 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 118.107 0.412 . . . . 0.0 109.925 -178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.9 p -71.74 -31.16 66.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 118.925 0.784 . . . . 0.0 111.801 -171.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -62.88 -16.53 59.16 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.718 0.69 . . . . 0.0 111.467 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -117.95 25.0 10.66 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.093 1.757 . . . . 0.0 109.814 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.8 m -133.52 158.54 42.88 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.312 1.845 . . . . 0.0 107.554 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -62.97 -48.15 80.09 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 118.443 -0.789 . . . . 0.0 112.371 -173.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.0 m 153.91 -175.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 1 C-N-CA 131.768 4.027 . . . . 0.0 108.192 -177.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . 0.333 10.2 pt-20 59.62 -43.4 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 131.486 3.914 . . . . 0.0 117.427 173.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 18.9 tt -155.3 153.01 8.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 120.729 1.604 . . . . 0.0 110.024 -176.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -148.06 172.24 14.57 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 126.038 1.735 . . . . 0.0 108.429 170.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.5 tp -140.8 116.18 10.05 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 47' ' ' ASN . 8.7 mp -84.65 -155.85 0.22 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.447 1.499 . . . . 0.0 108.912 178.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.61 15.63 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 128.187 2.595 . . . . 0.0 114.205 -176.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.55 -10.54 1.28 Allowed Glycine 0 CA--C 1.53 0.969 0 C-N-CA 126.004 1.764 . . . . 0.0 112.1 -176.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.2 mt -112.88 119.8 39.24 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 118.358 1.079 . . . . 0.0 109.319 -171.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 53.2 m -72.69 144.34 47.74 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 171.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 3.9 p -136.97 134.34 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.0 t -114.45 137.99 45.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -154.69 166.63 32.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 120.595 0.235 . . . . 0.0 111.027 -169.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -152.05 175.91 12.06 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 123.763 0.825 . . . . 0.0 108.913 169.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 m -141.15 133.4 28.07 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -144.46 145.75 32.07 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.48 0.712 . . . . 0.0 109.957 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.8 mp 49.31 -86.22 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.971 2.108 . . . . 0.0 111.614 -171.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -149.06 28.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.961 2.104 . . . . 0.0 108.978 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.405 HD11 HG22 ' A' ' 18' ' ' ILE . 57.5 tp -132.96 144.66 50.27 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.529 1.532 . . . . 0.0 109.198 -169.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -125.78 137.44 53.79 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -176.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -129.13 141.36 51.21 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.646 1.178 . . . . 0.0 108.214 -171.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -147.23 148.54 31.58 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 123.809 0.844 . . . . 0.0 110.866 -169.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 66.5 t -135.84 125.71 41.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 170.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.3 mp -114.78 137.67 47.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 -177.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -159.33 178.41 35.48 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-O 122.519 1.066 . . . . 0.0 113.294 177.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.9 m -65.27 133.84 52.33 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 112.972 -1.614 . . . . 0.0 107.798 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 17.2 m -78.56 48.17 0.77 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.836 1.254 . . . . 0.0 110.831 -179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -72.55 64.97 0.64 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.041 2.537 . . . . 0.0 110.617 -174.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 54.53 14.19 0.79 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 127.393 2.277 . . . . 0.0 113.754 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -162.76 160.67 25.64 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 126.833 2.053 . . . . 0.0 107.48 -171.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.98 -5.64 1.89 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.062 2.145 . . . . 0.0 110.047 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.9 mt -61.25 -34.42 75.12 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.447 1.099 . . . . 0.0 110.671 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -64.38 -33.91 76.94 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.022 0.828 . . . . 0.0 112.054 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.5 mt -71.77 -41.91 67.82 Favored 'General case' 0 N--CA 1.46 0.065 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 2.1 mtp -60.29 -37.06 79.35 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.714 173.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.01 63.3 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.713 0.805 . . . . 0.0 109.851 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.2 t -61.56 -44.91 99.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-N 118.237 0.471 . . . . 0.0 109.869 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.89 -51.44 69.6 Favored 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 123.261 0.624 . . . . 0.0 109.744 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -62.16 -45.57 92.81 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.631 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 85.8 m -60.99 -42.81 99.14 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 119.083 0.856 . . . . 0.0 111.073 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.4 tp -68.56 -48.18 64.93 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.92 0.782 . . . . 0.0 110.794 -177.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -64.15 -40.29 95.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.941 -0.475 . . . . 0.0 110.824 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -77.21 -33.8 56.19 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.239 -0.913 . . . . 0.0 111.624 -177.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.5 p -64.86 -42.26 95.01 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.729 1.15 . . . . 0.0 109.85 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 59.5 mt -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.344 0.34 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 169.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 15.8 m -61.13 -13.59 18.64 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 178.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 37.5 mm-40 -94.9 -37.75 11.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 120.611 1.55 . . . . 0.0 112.111 172.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -97.92 -0.95 43.95 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -175.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 18.0 tp -134.99 52.64 2.03 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.981 1.712 . . . . 0.0 109.206 -171.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -68.73 61.9 0.1 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.77 2.028 . . . . 0.0 112.627 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.428 ' HG3' ' H ' ' A' ' 108' ' ' ASN . 15.0 ptmt -138.29 -66.58 0.49 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.319 1.848 . . . . 0.0 106.952 169.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.428 ' H ' ' HG3' ' A' ' 107' ' ' LYS . 5.8 m-20 -163.6 150.04 11.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 129.102 2.961 . . . . 0.0 103.354 169.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.61 40.89 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 118.829 0.74 . . . . 0.0 109.962 171.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -86.2 172.74 10.29 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.242 1.017 . . . . 0.0 111.912 -173.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -54.81 -53.59 53.26 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 124.525 1.13 . . . . 0.0 112.51 -172.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 42.0 mmt180 -65.0 -39.23 93.15 Favored 'General case' 0 N--CA 1.463 0.202 0 O-C-N 121.979 -0.451 . . . . 0.0 110.19 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -64.53 -39.87 94.57 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.194 0.452 . . . . 0.0 111.228 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . 0.303 0.0 OUTLIER -76.43 -29.78 57.14 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 120.98 -1.075 . . . . 0.0 110.864 178.39 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 66.6 tp -60.78 -36.14 78.25 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.726 0.694 . . . . 0.0 111.188 169.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -65.86 -25.72 67.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.679 -0.638 . . . . 0.0 112.711 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -131.01 31.9 4.39 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.823 0.849 . . . . 0.0 112.607 -173.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -39.18 -48.53 1.76 Allowed 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.816 1.646 . . . . 0.0 112.585 175.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -67.34 -35.45 79.4 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.676 0.671 . . . . 0.0 111.883 -176.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -61.72 -42.53 99.76 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 172.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.75 -45.94 92.37 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.052 0.941 . . . . 0.0 111.23 173.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -54.99 -47.04 75.15 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.318 0.963 . . . . 0.0 109.788 175.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 74.3 mt -67.44 -32.8 73.91 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.673 -179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.59 -45.64 86.1 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.086 0.857 . . . . 0.0 110.151 174.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.33 -41.55 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 118.57 0.623 . . . . 0.0 109.924 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.91 -24.04 63.98 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.213 1.005 . . . . 0.0 112.574 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -91.85 -41.76 10.45 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.586 0.63 . . . . 0.0 110.927 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.65 -38.07 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 118.814 0.734 . . . . 0.0 109.481 -177.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 38.6 t -131.14 144.87 36.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 124.371 1.068 . . . . 0.0 109.21 -171.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -142.07 126.26 17.47 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 124.869 1.268 . . . . 0.0 107.687 169.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 56.92 30.29 59.97 Favored Glycine 0 CA--C 1.534 1.222 0 CA-C-O 119.361 -0.688 . . . . 0.0 113.35 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 77.32 12.21 84.79 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-N 118.335 1.067 . . . . 0.0 113.554 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 38.2 t -120.61 139.83 46.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 177.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 28.7 pt -56.4 138.82 16.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-O 121.196 0.522 . . . . 0.0 110.066 173.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -127.46 -35.62 2.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.581 1.553 . . . . 0.0 109.409 -171.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -138.93 151.64 47.07 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 170.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 15.5 m -139.24 29.25 2.23 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.776 1.231 . . . . 0.0 110.822 -169.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -137.98 121.69 11.57 Favored Pre-proline 0 CA--C 1.533 0.297 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 176.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.31 -34.95 9.12 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.702 2.268 . . . . 0.0 113.634 -171.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -73.55 -38.35 65.27 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.162 0.892 . . . . 0.0 109.835 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -63.2 -37.23 86.41 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.167 0.894 . . . . 0.0 110.409 174.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.24 -53.52 38.6 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-O 117.646 -1.169 . . . . 0.0 109.686 172.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 26.3 m -66.5 -33.53 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 121.109 1.777 . . . . 0.0 112.263 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -61.6 -48.72 79.66 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 119.176 0.898 . . . . 0.0 109.554 177.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -70.21 -34.34 72.79 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 121.398 -0.814 . . . . 0.0 111.101 -178.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 3.5 t -57.72 -45.77 86.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 O-C-N 121.394 -0.816 . . . . 0.0 109.633 171.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.05 -28.0 57.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 122.218 -0.301 . . . . 0.0 111.637 -175.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 54.3 mt -74.89 -26.57 59.75 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.286 1.034 . . . . 0.0 112.13 175.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 57.4 mtt85 . . . . . 0 C--O 1.249 1.073 0 CA-C-N 119.14 0.882 . . . . 0.0 110.09 171.18 . . . . . . . . 0 0 . 1 stop_ save_