data_2k40_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 2k40 _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 ' 8' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 . . . . . 0 CA--C 1.541 0.629 0 CA-C-O 120.986 0.422 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.0 t -65.87 145.76 55.55 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.153 0.581 . . . . 0.0 110.268 155.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.07 -19.71 63.21 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.089 -1.007 . . . . 0.0 113.121 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.83 -14.22 62.89 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.783 1.233 . . . . 0.0 113.432 170.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -98.16 -43.14 7.12 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.78 2.032 . . . . 0.0 110.13 172.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.3 -46.49 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.093 0.957 . . . . 0.0 110.913 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.34 69.2 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.91 -46.5 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 120.022 1.283 . . . . 0.0 109.638 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.32 -45.32 91.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.458 1.103 . . . . 0.0 112.206 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -48.62 -58.74 4.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.674 1.59 . . . . 0.0 113.009 166.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -68.06 -19.26 64.86 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -174.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 71.8 t -73.75 -51.42 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.896 1.278 . . . . 0.0 111.684 162.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -53.84 -30.2 44.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.881 1.673 . . . . 0.0 113.396 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -50.18 -52.94 31.35 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.438 1.017 . . . . 0.0 112.344 167.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.69 -49.45 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 127.982 2.513 . . . . 0.0 111.148 -173.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -131.63 96.52 3.98 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 112.294 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.6 -12.19 14.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.01 -1.056 . . . . 0.0 113.773 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -146.76 103.95 3.92 Favored Pre-proline 0 CA--C 1.547 0.839 0 O-C-N 120.324 -1.485 . . . . 0.0 110.82 160.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -75.77 176.15 10.37 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.674 2.916 . . . . 0.0 113.478 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -100.78 176.93 27.68 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.65 1.595 . . . . 0.0 113.364 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.8 mm -62.5 -39.93 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -65.7 -32.85 74.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.115 0.87 . . . . 0.0 113.045 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.5 mm -71.74 -38.58 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 123.696 0.798 . . . . 0.0 110.679 172.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.31 -47.86 77.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.726 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -41.41 94.41 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.517 1.053 . . . . 0.0 113.478 170.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.426 ' CG ' ' HZ1' ' A' ' 37' ' ' LYS . 39.2 t70 -56.61 -50.44 71.99 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.285 -1.509 . . . . 0.0 112.072 172.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.6 mt -61.54 -42.2 98.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.357 0.663 . . . . 0.0 112.25 174.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -53.5 57.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.674 1.19 . . . . 0.0 112.214 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -65.15 -29.85 70.72 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.426 ' HZ1' ' CG ' ' A' ' 33' ' ' ASP . 85.9 mttt -81.74 -56.45 3.99 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.745 1.218 . . . . 0.0 113.747 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 89.6 mt -74.08 -10.13 59.32 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.341 1.456 . . . . 0.0 113.781 -171.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 48.4 70.27 0.47 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.409 1.884 . . . . 0.0 111.476 -159.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.9 mt -135.24 158.5 44.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.488 1.915 . . . . 0.0 108.573 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -88.02 145.68 25.87 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.266 1.426 . . . . 0.0 110.403 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.3 tt -48.49 -41.29 29.42 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -54.18 -49.22 69.81 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.183 1.393 . . . . 0.0 112.749 175.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -59.9 -40.46 88.86 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.895 -1.128 . . . . 0.0 111.969 175.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -74.95 -34.08 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 118.745 0.702 . . . . 0.0 112.446 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -57.45 -52.46 65.27 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.424 1.011 . . . . 0.0 111.786 167.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -57.8 -37.92 62.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.255 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -61.35 -58.72 7.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 120.83 1.65 . . . . 0.0 112.361 172.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -57.94 -42.06 84.1 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -70.53 -38.84 74.29 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 120.623 -1.298 . . . . 0.0 113.466 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -62.73 -32.77 73.95 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 121.02 1.736 . . . . 0.0 111.985 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -58.81 6.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.582 1.153 . . . . 0.0 113.074 172.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 -56.25 -50.09 72.33 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.363 0.665 . . . . 0.0 111.846 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.807 1.039 . . . . 0.0 113.807 174.031 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.2 t -67.86 140.79 56.56 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.918 1.687 . . . . 0.0 110.488 162.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.54 -32.84 65.52 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -61.96 -33.69 74.75 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.0 1.273 . . . . 0.0 113.461 175.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.09 -40.63 45.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.726 1.21 . . . . 0.0 111.403 174.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.61 -56.21 16.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.638 0 CA-C-N 118.518 0.599 . . . . 0.0 110.616 173.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.7 -10.64 57.56 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.6 t -82.25 -52.23 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.156 0.983 . . . . 0.0 110.838 161.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -57.62 -48.1 80.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.33 1.052 . . . . 0.0 112.797 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -58.31 -38.82 77.84 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.14 1.376 . . . . 0.0 112.444 171.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -60.47 -32.53 71.49 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.9 t -73.05 -50.96 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.266 0.939 . . . . 0.0 110.559 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -54.87 -28.7 52.12 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.825 1.25 . . . . 0.0 114.01 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -56.13 -63.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.328 1.851 . . . . 0.0 112.374 165.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.6 -35.14 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -141.72 106.24 4.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.22 1.408 . . . . 0.0 111.497 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -61.91 -26.25 68.06 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.898 -1.126 . . . . 0.0 113.344 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -121.77 96.4 47.18 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 127.343 2.257 . . . . 0.0 109.615 166.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -62.52 166.28 13.73 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.32 2.013 . . . . 0.0 111.78 167.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.55 165.27 54.37 Favored Glycine 0 CA--C 1.534 1.242 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 163.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.0 mm -62.07 -32.44 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 O-C-N 121.705 -0.88 . . . . 0.0 111.281 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.58 -29.25 69.83 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.873 1.669 . . . . 0.0 112.655 177.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 52.6 mt -80.5 -38.75 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 123.891 0.876 . . . . 0.0 109.655 174.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.3 mt -63.0 -43.04 99.87 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.487 -0.758 . . . . 0.0 111.649 171.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -55.64 32.28 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.497 -1.24 . . . . 0.0 112.728 164.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -55.67 -39.06 70.44 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.448 1.931 . . . . 0.0 112.889 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.84 -53.79 53.78 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.089 0.956 . . . . 0.0 111.452 170.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.07 -55.85 18.08 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.862 1.21 . . . . 0.0 112.186 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.8 mm-40 -54.91 -40.28 69.68 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.401 1.88 . . . . 0.0 111.808 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -27.13 30.91 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 178.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.9 -19.64 15.18 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 120.026 1.284 . . . . 0.0 114.048 -171.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 62.34 32.42 16.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.194 1.797 . . . . 0.0 113.764 -170.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.2 mt -90.96 171.54 9.21 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.803 150.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.04 163.67 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.333 1.063 . . . . 0.0 112.926 161.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.87 -51.74 4.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.711 2.004 . . . . 0.0 112.143 172.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -53.43 -55.36 25.84 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.202 1.801 . . . . 0.0 114.062 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.7 mtt85 -65.49 -34.41 78.22 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.202 -0.936 . . . . 0.0 111.504 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.2 mt -71.22 -41.19 74.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.033 0.833 . . . . 0.0 112.032 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -57.38 -53.44 58.08 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.155 1.343 . . . . 0.0 110.922 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.3 mt -56.06 -43.14 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.984 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -56.42 -56.56 19.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.349 1.431 . . . . 0.0 112.61 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -56.86 -48.61 77.71 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.596 0.759 . . . . 0.0 112.336 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -63.08 -44.23 96.33 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.018 -0.992 . . . . 0.0 111.181 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -62.85 -34.54 77.58 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.28 1.4 . . . . 0.0 112.78 174.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -65.45 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.837 1.255 . . . . 0.0 112.467 170.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -41.31 82.43 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 119.481 1.037 . . . . 0.0 113.298 177.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.003 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.998 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 . . . . . 0 CA--C 1.543 0.675 0 CA-C-O 122.092 0.948 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.0 t -76.31 153.65 35.71 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.188 -0.945 . . . . 0.0 111.657 161.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -53.97 -40.18 66.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 123.852 0.861 . . . . 0.0 112.787 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -63.9 -9.58 16.13 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -101.62 -38.25 8.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.297 1.839 . . . . 0.0 111.807 168.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -55.47 -51.85 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.12 0.968 . . . . 0.0 110.873 172.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -60.48 -29.85 69.32 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -176.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 64.7 t -70.56 -46.66 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 119.28 0.946 . . . . 0.0 110.652 172.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.1 mt -64.19 -46.75 82.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.624 1.17 . . . . 0.0 111.544 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -51.94 -53.27 43.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.702 . . . . 0.0 112.309 165.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -55.41 -30.21 60.01 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 178.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 92.0 t -72.54 -55.16 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 119.609 1.095 . . . . 0.0 111.039 166.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -51.84 -32.02 30.17 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.517 1.527 . . . . 0.0 113.873 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -67.04 -22.91 65.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.418 2.687 . . . . 0.0 114.662 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 m -117.52 -35.75 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.015 1.726 . . . . 0.0 113.096 174.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -114.55 78.32 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.491 1.916 . . . . 0.0 109.379 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.4 m -55.99 -20.37 16.2 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.568 1.547 . . . . 0.0 114.833 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -143.81 98.29 5.29 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.228 1.011 . . . . 0.0 109.678 165.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.91 169.54 20.12 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.45 2.1 . . . . 0.0 111.516 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.49 167.11 33.6 Favored Glycine 0 CA--C 1.532 1.121 0 O-C-N 121.762 -0.586 . . . . 0.0 112.4 169.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.27 -29.96 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 117.944 -1.027 . . . . 0.0 111.993 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -40.04 86.07 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.703 1.592 . . . . 0.0 112.963 171.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mm -69.82 -38.57 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 118.722 0.692 . . . . 0.0 110.929 173.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 79.3 mt -66.57 -45.34 79.62 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.377 -0.827 . . . . 0.0 112.55 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -52.8 -58.21 7.62 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.858 2.063 . . . . 0.0 112.458 165.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.39 -36.4 82.18 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.844 1.202 . . . . 0.0 112.877 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.1 mt -60.42 -48.09 83.28 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.649 1.113 . . . . 0.0 111.938 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.09 -56.23 23.31 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.797 1.239 . . . . 0.0 110.341 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.76 -2.78 1.93 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.557 1.943 . . . . 0.0 115.44 176.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -128.9 -18.34 3.81 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 120.753 1.615 . . . . 0.0 114.885 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -97.41 1.88 49.77 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.05 2.14 . . . . 0.0 111.987 163.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.3 t30 43.57 60.18 2.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 128.485 2.714 . . . . 0.0 113.843 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -119.39 173.76 6.77 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.691 2.796 . . . . 0.0 108.097 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.422 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 4.9 pm0 -96.73 166.62 11.56 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 120.814 -1.179 . . . . 0.0 112.637 164.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.6 tp -52.37 -47.38 66.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.419 177.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -53.46 52.75 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.063 0.847 . . . . 0.0 112.184 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.422 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 53.7 mtt180 -65.52 -30.01 70.71 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.709 1.141 . . . . 0.0 112.354 -173.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.4 mt -78.42 -39.97 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.632 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -54.35 -53.6 51.74 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 120.659 1.572 . . . . 0.0 112.627 170.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.74 -36.16 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 117.304 -1.332 . . . . 0.0 110.81 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -58.93 -61.55 2.55 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.511 1.96 . . . . 0.0 111.77 169.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -55.48 -49.9 71.29 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.087 0.858 . . . . 0.0 112.183 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -60.84 -35.39 76.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.294 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -64.26 -51.96 61.01 Favored 'General case' 0 C--N 1.347 0.5 0 CA-C-N 120.81 1.641 . . . . 0.0 111.604 171.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -58.75 -47.27 85.24 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 120.582 1.537 . . . . 0.0 111.545 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -35.12 79.35 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.94 1.296 . . . . 0.0 113.113 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.825 0 CA-C-N 119.466 1.03 . . . . 0.0 113.479 167.941 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 . . . . . 0 CA--C 1.549 0.912 0 CA-C-O 121.773 0.797 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.4 t -84.16 147.26 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.087 -1.008 . . . . 0.0 110.249 158.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -57.62 -32.25 67.04 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.67 1.123 . . . . 0.0 112.188 176.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.45 -31.5 62.0 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.461 1.504 . . . . 0.0 113.081 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -88.58 -41.51 12.63 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 126.175 1.79 . . . . 0.0 111.026 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.3 mm -51.99 -47.29 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.819 0.848 . . . . 0.0 110.849 171.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.75 -50.91 17.39 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.8 t -66.59 -41.33 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 O-C-N 121.37 -0.831 . . . . 0.0 111.002 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.07 -46.42 81.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.583 1.153 . . . . 0.0 112.361 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -66.01 -36.31 82.92 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.964 -1.085 . . . . 0.0 112.862 172.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -59.9 -32.45 70.76 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.99 -50.89 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.824 1.193 . . . . 0.0 111.358 168.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -53.3 -32.92 51.17 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.231 1.412 . . . . 0.0 113.5 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -60.03 -26.02 65.78 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.774 2.43 . . . . 0.0 114.064 173.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.7 t -108.09 -38.14 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 126.326 1.85 . . . . 0.0 111.884 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -127.53 85.21 2.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.481 1.513 . . . . 0.0 110.155 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -53.58 -33.02 53.34 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.518 1.527 . . . . 0.0 113.005 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -117.46 119.02 34.87 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 123.935 0.894 . . . . 0.0 109.426 154.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -75.74 172.01 17.1 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.392 2.728 . . . . 0.0 111.693 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.79 171.37 50.92 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 123.972 0.796 . . . . 0.0 112.221 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.8 mm -64.3 -48.56 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.736 -0.861 . . . . 0.0 110.307 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.58 -28.92 49.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.194 2.198 . . . . 0.0 113.878 173.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.7 mt -80.46 -34.8 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 123.727 0.811 . . . . 0.0 110.605 175.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -67.23 -45.59 76.32 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.868 0.867 . . . . 0.0 111.746 169.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.03 -54.99 36.02 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.093 1.757 . . . . 0.0 112.354 169.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -59.66 -43.59 93.88 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.282 0.946 . . . . 0.0 111.781 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.9 mt -62.41 -42.88 99.77 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 120.964 -1.085 . . . . 0.0 112.728 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.05 -58.63 7.57 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.225 0.921 . . . . 0.0 110.884 173.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -61.39 -32.86 72.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.8 1.24 . . . . 0.0 113.59 -176.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.7 tttp -90.46 -45.02 9.23 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.751 1.221 . . . . 0.0 113.524 -173.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.77 -12.0 60.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.325 1.05 . . . . 0.0 113.061 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 80.99 60.28 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.328 2.651 . . . . 0.0 110.488 171.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.3 mt -136.75 -164.48 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.785 2.834 . . . . 0.0 109.231 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.15 149.05 51.03 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.877 1.271 . . . . 0.0 110.691 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.56 -38.14 66.29 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.71 1.204 . . . . 0.0 113.452 -169.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -55.87 -42.01 75.24 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.598 1.09 . . . . 0.0 112.865 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -67.67 -37.62 82.61 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.114 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.4 mm -72.02 -38.59 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 118.606 0.639 . . . . 0.0 111.854 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.65 -57.5 12.13 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.17 1.388 . . . . 0.0 111.393 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.5 mt -57.38 -41.91 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.751 0.705 . . . . 0.0 110.826 175.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -59.59 -55.22 37.23 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.516 1.053 . . . . 0.0 112.858 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -62.75 -44.83 95.19 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.339 0.972 . . . . 0.0 111.135 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.79 -44.52 86.35 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.424 1.011 . . . . 0.0 111.59 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -60.34 -49.7 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.773 1.169 . . . . 0.0 112.194 173.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -58.07 9.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.136 0.974 . . . . 0.0 112.43 176.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -38.27 87.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.702 1.601 . . . . 0.0 111.867 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.625 0 CA-C-N 120.012 1.278 . . . . 0.0 112.165 171.789 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 CA--C 1.55 0.963 0 CA-C-O 122.309 1.052 . . . . 0.0 113.224 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -66.46 147.05 53.84 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.725 0.81 . . . . 0.0 110.41 158.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -52.09 -34.99 46.47 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.788 0.835 . . . . 0.0 112.717 172.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.13 -11.48 60.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -89.71 -44.69 9.84 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.338 1.855 . . . . 0.0 110.407 166.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.8 mm -54.69 -42.35 60.73 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 C-N-CA 125.4 1.48 . . . . 0.0 110.765 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -50.42 -47.45 56.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 173.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -67.61 -43.07 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.653 1.115 . . . . 0.0 110.081 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.87 -43.38 88.52 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.263 1.025 . . . . 0.0 112.213 -179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.41 ' CD ' HH12 ' A' ' 52' ' ' ARG . 24.2 mt-10 -63.45 -43.36 97.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.724 1.147 . . . . 0.0 113.006 170.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -59.4 -36.5 75.94 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.8 t -71.45 -45.55 68.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 120.227 1.376 . . . . 0.0 111.483 171.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -54.3 -34.34 60.74 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.078 0.951 . . . . 0.0 113.047 176.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -54.02 -39.23 65.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.738 2.015 . . . . 0.0 113.733 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.91 -45.98 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.594 1.558 . . . . 0.0 110.821 174.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -130.17 88.45 2.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.8 1.64 . . . . 0.0 111.498 -168.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.9 m -58.01 -21.49 45.15 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -153.24 88.37 3.77 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.275 1.83 . . . . 0.0 108.58 172.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.96 177.91 8.16 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.52 2.813 . . . . 0.0 112.78 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.07 164.84 54.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.657 0.646 . . . . 0.0 113.744 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 27.3 mm -62.07 -43.38 97.63 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 O-C-N 121.97 -0.724 . . . . 0.0 112.311 -171.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.42 -23.73 64.61 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.389 0.995 . . . . 0.0 113.175 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 22.8 mm -81.71 -40.61 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.674 1.59 . . . . 0.0 110.173 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.67 -49.82 71.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.07 0.948 . . . . 0.0 111.624 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.98 -39.24 85.02 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 169.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.04 -48.46 67.6 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 120.799 1.636 . . . . 0.0 112.702 170.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.2 mt -67.69 -40.08 84.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.83 0.852 . . . . 0.0 112.12 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.63 -55.92 21.66 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.608 1.163 . . . . 0.0 110.992 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -62.9 -51.74 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.753 -0.592 . . . . 0.0 111.954 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -72.43 -8.35 54.58 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.6 mt -120.87 4.63 10.49 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.026 1.33 . . . . 0.0 112.382 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.8 t30 37.23 75.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.425 2.69 . . . . 0.0 112.684 -165.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.5 mt -135.89 164.78 27.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.039 2.536 . . . . 0.0 107.79 169.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -87.91 155.24 19.95 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 120.704 -1.248 . . . . 0.0 112.184 166.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -45.01 -49.91 11.03 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.38 1.872 . . . . 0.0 111.646 175.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.08 -39.13 77.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.643 1.177 . . . . 0.0 113.839 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.95 -43.22 79.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.749 -1.22 . . . . 0.0 111.141 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.5 mm -66.14 -42.01 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.621 0.646 . . . . 0.0 111.026 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -56.5 -52.09 66.05 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.318 0.963 . . . . 0.0 112.123 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -59.25 -37.68 70.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.25 -0.906 . . . . 0.0 111.58 173.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -60.66 -59.93 4.6 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 120.514 1.506 . . . . 0.0 112.267 171.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -55.17 -47.42 75.19 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.975 0.51 . . . . 0.0 111.59 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -62.66 -39.45 93.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 116.831 -1.557 . . . . 0.0 112.856 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -60.65 -40.04 90.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 121.427 1.921 . . . . 0.0 111.443 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.41 HH12 ' CD ' ' A' ' 17' ' ' GLU . 12.4 mmt85 -66.22 -55.46 16.08 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER -69.04 -18.4 64.01 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 177.809 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 CA-C-N 119.745 1.157 . . . . 0.0 111.368 162.311 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.538 0.516 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.6 t -57.07 145.96 29.03 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.634 -0.667 . . . . 0.0 111.042 162.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -58.81 -24.08 61.36 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.38 -41.16 96.66 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.372 0.987 . . . . 0.0 113.398 169.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -79.92 -30.68 40.08 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.156 0.982 . . . . 0.0 111.816 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mm -62.36 -49.14 85.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.478 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.281 168.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.26 -31.06 71.58 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.296 1.407 . . . . 0.0 114.213 -176.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 75.4 t -66.12 -46.82 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.018 0.826 . . . . 0.0 110.758 170.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.4 -43.08 86.78 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.305 1.042 . . . . 0.0 112.654 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -52.99 -52.57 57.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.846 1.658 . . . . 0.0 112.135 164.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -54.43 -46.42 73.23 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.899 0.772 . . . . 0.0 112.405 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 75.7 t -58.77 -52.02 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.362 172.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -56.23 -41.36 75.56 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.681 1.582 . . . . 0.0 112.177 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -61.73 -25.47 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.119 1.767 . . . . 0.0 113.521 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.6 t -100.65 -28.33 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.942 1.697 . . . . 0.0 112.284 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -140.96 83.6 1.89 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.59 2.356 . . . . 0.0 111.147 -171.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.5 m -57.42 -25.19 59.21 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -135.24 96.81 13.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.642 1.577 . . . . 0.0 109.944 166.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.92 163.61 38.29 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.472 2.115 . . . . 0.0 111.447 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.87 169.26 50.15 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.064 0.84 . . . . 0.0 113.176 172.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 mm -61.77 -38.64 80.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.695 -0.885 . . . . 0.0 111.937 -176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -30.19 69.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.955 1.302 . . . . 0.0 112.252 177.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.0 mt -71.65 -41.31 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 119.3 0.955 . . . . 0.0 110.038 170.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.02 -46.66 88.76 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.667 -0.646 . . . . 0.0 111.845 172.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -63.21 -37.9 89.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.686 1.595 . . . . 0.0 114.294 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -68.41 -38.81 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.016 -1.052 . . . . 0.0 111.924 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.14 -45.96 86.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.445 0.698 . . . . 0.0 111.329 170.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.87 -60.14 3.52 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.867 1.267 . . . . 0.0 111.388 174.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.4 tp60 -63.21 -27.02 69.07 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -107.48 -4.62 18.27 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -108.54 -6.53 16.05 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.77 2.028 . . . . 0.0 112.13 165.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.75 60.96 3.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.665 1.586 . . . . 0.0 111.388 -170.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.4 mt -131.53 155.24 47.79 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 127.372 2.269 . . . . 0.0 109.197 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.548 ' CD ' ' HE ' ' A' ' 44' ' ' ARG . 4.8 pm0 -76.36 142.89 41.04 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 122.784 1.278 . . . . 0.0 111.066 160.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.7 tt -50.58 -35.71 31.36 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 124.958 1.303 . . . . 0.0 111.594 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.33 -51.29 46.75 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.253 1.821 . . . . 0.0 113.229 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.548 ' HE ' ' CD ' ' A' ' 41' ' ' GLU . 85.9 mtt-85 -63.67 -41.55 98.16 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.559 -0.713 . . . . 0.0 111.395 176.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 48.5 mt -70.38 -37.2 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -61.35 -51.52 68.5 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.014 1.326 . . . . 0.0 110.533 172.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.4 mt -57.78 -42.49 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 118.079 -0.962 . . . . 0.0 110.404 173.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -58.1 -62.4 1.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.285 1.402 . . . . 0.0 112.277 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -55.6 -45.28 77.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.229 0.922 . . . . 0.0 112.519 -177.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -63.92 -38.61 91.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.534 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -60.96 -46.41 90.81 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.397 1.453 . . . . 0.0 112.502 170.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.94 -50.72 72.28 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.392 0.996 . . . . 0.0 111.866 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -57.02 -43.69 82.1 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.054 0.941 . . . . 0.0 112.166 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.847 0 CA-C-N 119.102 0.864 . . . . 0.0 113.071 173.482 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 121.692 0.758 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.33 144.42 53.99 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.962 -0.461 . . . . 0.0 109.792 156.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.32 -28.45 67.99 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.362 -1.461 . . . . 0.0 113.395 -174.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -68.84 -1.81 8.07 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.93 1.455 . . . . 0.0 114.93 170.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -104.82 -38.74 6.55 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.129 1.772 . . . . 0.0 111.031 166.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mm -55.43 -53.06 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.585 0.754 . . . . 0.0 111.352 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.92 -26.82 68.47 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -176.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.8 t -66.0 -51.44 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 120.405 1.457 . . . . 0.0 109.849 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -59.0 -47.12 86.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.608 0.763 . . . . 0.0 111.504 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.09 -30.32 66.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 117.183 -1.389 . . . . 0.0 114.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -66.28 -17.21 64.61 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 121.072 1.76 . . . . 0.0 112.948 166.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.62 -52.0 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 120.266 1.394 . . . . 0.0 111.859 161.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -55.47 -31.34 61.9 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.035 . . . . 0.0 113.722 178.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -53.27 -11.94 0.35 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 131.488 3.915 . . . . 0.0 115.423 168.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 44.2 t -132.77 -54.59 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 127.3 2.24 . . . . 0.0 110.703 175.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -100.87 92.0 4.85 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.731 1.613 . . . . 0.0 111.582 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.6 m -55.2 -32.35 62.15 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 176.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -144.69 97.33 5.01 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.386 1.875 . . . . 0.0 108.682 170.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -79.37 179.85 6.02 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.371 2.714 . . . . 0.0 113.116 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.21 162.16 54.46 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.253 0.93 . . . . 0.0 113.202 169.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 mm -68.04 -29.86 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 O-C-N 121.837 -0.802 . . . . 0.0 111.311 -178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.98 -33.47 75.81 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.373 1.869 . . . . 0.0 113.335 171.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.6 mm -71.42 -41.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 119.021 0.828 . . . . 0.0 110.434 170.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.44 -41.57 96.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.864 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.26 -50.41 74.09 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.876 2.07 . . . . 0.0 113.172 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -58.45 -41.02 84.19 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.595 1.089 . . . . 0.0 112.523 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.16 -48.64 72.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.053 0.941 . . . . 0.0 112.077 170.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -48.14 69.86 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.282 1.033 . . . . 0.0 111.864 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -55.88 -60.08 3.97 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.374 1.07 . . . . 0.0 112.394 171.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -65.43 -2.39 3.22 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.2 mt -128.26 -6.33 5.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.275 1.43 . . . . 0.0 113.701 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 43.45 73.15 0.15 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.067 1.347 . . . . 0.0 110.928 -158.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.45 -173.89 3.48 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.344 1.857 . . . . 0.0 109.199 171.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -137.2 150.13 47.68 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 125.273 1.429 . . . . 0.0 110.347 -177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.2 tp -42.39 -54.34 3.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.796 1.239 . . . . 0.0 114.328 -171.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.07 -30.24 70.86 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.55 1.068 . . . . 0.0 113.684 -178.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -71.92 -37.5 70.04 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.962 1.255 . . . . 0.0 110.643 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -46.82 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.891 0.769 . . . . 0.0 111.454 171.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -54.37 -50.48 67.4 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.482 1.037 . . . . 0.0 112.135 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -62.3 -38.9 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 120.649 -1.282 . . . . 0.0 111.511 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -57.41 -57.34 13.08 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 120.324 1.42 . . . . 0.0 111.971 170.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -56.9 -48.58 77.89 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.286 1.034 . . . . 0.0 111.553 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -61.52 -41.29 97.1 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.07 0.948 . . . . 0.0 111.909 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.87 -41.53 95.6 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 120.512 1.506 . . . . 0.0 111.951 174.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -59.99 4.07 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.47 1.108 . . . . 0.0 112.079 172.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -54.08 -49.19 69.64 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.342 1.457 . . . . 0.0 111.45 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.679 0 CA-C-N 118.906 0.775 . . . . 0.0 112.895 175.922 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -76.59 152.71 35.83 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.074 0.95 . . . . 0.0 109.982 158.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -59.81 -38.71 82.72 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.435 -1.415 . . . . 0.0 113.044 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.83 -10.35 56.34 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -90.04 -47.43 7.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.771 1.628 . . . . 0.0 110.9 163.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.437 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 22.1 mm -50.94 -47.75 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.367 1.067 . . . . 0.0 111.972 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -61.02 -23.59 65.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.1 t -68.7 -50.76 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 120.063 1.301 . . . . 0.0 110.114 169.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.8 mp -62.13 -43.68 98.3 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 176.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.72 -42.45 79.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.778 -1.201 . . . . 0.0 113.651 169.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.5 -23.71 67.09 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 173.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.4 t -77.3 -47.0 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 119.91 1.232 . . . . 0.0 111.155 165.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -61.92 -30.96 71.24 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.85 1.66 . . . . 0.0 114.225 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -59.59 -17.99 37.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.076 1.307 . . . . 0.0 113.993 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.8 t -113.22 -37.64 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 126.556 1.943 . . . . 0.0 112.076 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -111.61 91.46 3.67 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.095 1.358 . . . . 0.0 112.274 -170.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -57.18 -30.5 64.56 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.472 -0.767 . . . . 0.0 112.868 167.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -139.46 114.83 8.18 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 127.854 2.462 . . . . 0.0 108.792 158.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -76.99 179.11 6.84 Favored 'Trans proline' 0 CA--C 1.55 1.31 0 C-N-CA 122.553 2.169 . . . . 0.0 110.724 167.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.71 166.02 39.07 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.442 -0.786 . . . . 0.0 113.196 170.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.2 mm -66.46 -36.89 78.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.848 -177.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.95 -26.56 68.27 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.608 1.549 . . . . 0.0 112.643 173.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.4 mm -74.55 -37.22 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.047 -1.033 . . . . 0.0 111.055 170.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 38.1 mt -67.5 -42.19 83.25 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.481 -0.762 . . . . 0.0 112.107 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.45 -49.02 77.59 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.788 1.635 . . . . 0.0 113.055 167.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -60.1 -43.41 95.59 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.458 1.026 . . . . 0.0 112.14 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.0 -45.89 93.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.883 0.873 . . . . 0.0 112.075 171.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.36 -51.56 67.86 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.228 1.011 . . . . 0.0 111.519 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -52.94 -63.51 1.12 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.944 1.297 . . . . 0.0 112.418 170.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -69.72 -13.67 62.41 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -171.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.75 1.76 13.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.465 1.106 . . . . 0.0 112.978 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 39.09 68.29 0.37 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.53 2.332 . . . . 0.0 112.856 -162.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.7 mt -120.45 -166.68 1.35 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.385 2.274 . . . . 0.0 109.036 171.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -134.19 159.19 41.66 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.812 -1.18 . . . . 0.0 110.504 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -44.69 -55.27 5.41 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.287 1.835 . . . . 0.0 112.2 -175.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -66.06 -27.37 68.04 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -65.88 -37.7 86.82 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 121.548 1.976 . . . . 0.0 110.766 171.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -41.71 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 118.342 0.519 . . . . 0.0 111.404 174.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -57.99 -52.99 63.22 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.099 0.863 . . . . 0.0 111.747 173.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.71 -36.14 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.96 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.437 ' HE1' ' CD1' ' A' ' 13' ' ' ILE . 71.2 t90 -61.89 -60.17 4.04 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.378 1.444 . . . . 0.0 112.218 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -59.74 -43.26 94.32 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.464 0.575 . . . . 0.0 111.385 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -49.03 79.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.918 175.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -59.16 -39.67 83.21 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.858 1.663 . . . . 0.0 111.461 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -62.98 1.43 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.194 0.998 . . . . 0.0 112.694 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.27 5.1 ptm180 -63.18 -35.36 80.05 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.992 1.269 . . . . 0.0 112.985 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 176.397 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.416 ' H ' HD13 ' A' ' 13' ' ' ILE . 30.3 m-85 . . . . . 0 CA--C 1.539 0.557 0 CA-C-O 121.424 0.631 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.3 t -70.86 148.7 47.53 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.026 -0.421 . . . . 0.0 110.468 164.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -49.62 -41.9 43.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.615 1.966 . . . . 0.0 113.874 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -16.59 61.48 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 120.33 1.423 . . . . 0.0 113.838 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -84.12 -40.68 17.94 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.496 1.119 . . . . 0.0 110.32 167.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.416 HD13 ' H ' ' A' ' 8' ' ' PHE . 26.5 mm -54.0 -51.59 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.104 0.962 . . . . 0.0 111.586 171.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.0 -37.24 66.34 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 85.3 t -66.67 -47.63 82.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.334 1.425 . . . . 0.0 110.857 174.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.76 -43.87 95.15 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.572 1.149 . . . . 0.0 112.22 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -49.87 -55.52 14.01 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.652 1.581 . . . . 0.0 111.087 164.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 -58.27 -12.94 4.15 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.899 1.815 . . . . 0.0 115.899 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 98.9 t -86.76 -49.62 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 120.714 1.597 . . . . 0.0 111.701 161.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -54.09 -30.53 48.83 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.342 1.057 . . . . 0.0 113.78 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -53.63 -28.13 31.11 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.783 1.233 . . . . 0.0 114.038 175.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.1 t -110.2 -48.92 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.876 2.07 . . . . 0.0 111.451 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -110.62 82.83 1.66 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.798 1.239 . . . . 0.0 111.667 -175.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.3 m -54.4 -33.88 60.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.272 -0.893 . . . . 0.0 112.501 169.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -124.9 103.03 31.05 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 126.757 2.023 . . . . 0.0 108.971 167.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -81.18 176.37 8.87 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.859 3.039 . . . . 0.0 112.739 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.94 163.45 31.92 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.519 1.057 . . . . 0.0 112.876 169.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.9 mm -59.43 -38.11 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.019 1.328 . . . . 0.0 111.127 -177.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.52 -27.57 61.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.759 2.024 . . . . 0.0 112.325 -177.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 57.5 mt -76.45 -39.85 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 170.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.5 mt -62.06 -46.18 90.25 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.682 0.793 . . . . 0.0 111.344 172.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.85 -49.93 75.02 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 165.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.47 -30.35 66.91 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.22 1.827 . . . . 0.0 114.614 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -70.57 -49.76 44.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.842 0.857 . . . . 0.0 112.263 167.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.37 64.07 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.671 1.189 . . . . 0.0 112.324 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.73 -12.36 46.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.595 2.758 . . . . 0.0 114.012 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -118.74 -34.89 3.83 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.849 1.26 . . . . 0.0 113.873 -176.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.9 mt -85.95 -13.36 47.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.96 0.904 . . . . 0.0 113.058 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 67.97 65.84 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.285 2.234 . . . . 0.0 111.856 -169.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.9 mt -139.36 177.93 7.56 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.221 2.208 . . . . 0.0 109.699 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -115.46 158.85 21.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.83 1.252 . . . . 0.0 112.002 165.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.19 -41.27 68.38 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.492 1.117 . . . . 0.0 113.796 -169.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -33.74 73.66 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.478 1.035 . . . . 0.0 113.257 176.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -68.69 -39.25 80.64 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.628 -1.295 . . . . 0.0 110.546 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.61 -47.72 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.04 171.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -54.65 -49.98 69.29 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.751 1.159 . . . . 0.0 111.912 175.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.5 mt -62.5 -38.04 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 117.558 -1.211 . . . . 0.0 111.222 174.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -58.44 -58.21 9.54 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 121.029 1.74 . . . . 0.0 111.542 170.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -54.1 -51.39 64.33 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 118.91 0.777 . . . . 0.0 112.743 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.54 -40.59 83.41 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 118.21 -0.9 . . . . 0.0 112.275 174.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -62.35 -46.66 87.67 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 120.771 1.623 . . . . 0.0 112.896 174.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -61.57 -46.79 88.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 120.151 1.341 . . . . 0.0 111.529 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -47.3 85.69 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.801 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.504 0 C-N-CA 124.54 1.136 . . . . 0.0 111.623 173.64 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 121.457 0.646 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.2 t -66.81 147.07 53.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.265 0.626 . . . . 0.0 110.784 166.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -55.17 -35.37 64.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.42 1.088 . . . . 0.0 113.218 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -5.53 32.34 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 125.266 1.427 . . . . 0.0 114.707 175.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -109.15 -33.3 6.92 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.49 1.916 . . . . 0.0 111.143 167.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -55.27 -51.96 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.28 1.032 . . . . 0.0 111.343 167.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -57.2 -34.42 68.5 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.7 t -69.1 -39.34 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 119.952 1.251 . . . . 0.0 110.173 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.6 mt -69.13 -46.99 66.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.376 1.07 . . . . 0.0 111.495 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -58.19 -39.22 78.37 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.093 0.86 . . . . 0.0 112.523 170.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -61.91 -27.97 69.2 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.843 -1.161 . . . . 0.0 114.121 172.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.2 t -76.5 -50.77 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 119.975 1.261 . . . . 0.0 111.098 166.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.57 -34.48 71.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.571 1.148 . . . . 0.0 113.62 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -65.25 -17.81 64.8 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 174.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.9 t -98.48 -45.81 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.759 1.623 . . . . 0.0 110.77 174.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -133.25 108.03 8.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.456 1.102 . . . . 0.0 112.952 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.5 t -51.3 -39.86 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.043 1.737 . . . . 0.0 113.002 169.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.38 92.52 20.55 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 126.278 1.831 . . . . 0.0 110.533 175.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.26 176.46 10.07 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 123.185 2.59 . . . . 0.0 112.636 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.96 170.52 45.57 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.679 1.133 . . . . 0.0 114.647 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 21.8 mm -66.44 -34.89 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.716 -0.873 . . . . 0.0 111.769 -175.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.16 -29.88 70.06 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.171 1.389 . . . . 0.0 112.574 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mm -76.22 -40.82 36.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.118 0.967 . . . . 0.0 109.698 174.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.47 -47.74 82.67 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.723 -0.61 . . . . 0.0 112.06 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.72 -55.92 26.56 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.963 1.305 . . . . 0.0 112.401 168.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -62.8 -22.23 66.48 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.24 -1.538 . . . . 0.0 114.013 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -76.42 -50.04 15.17 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.016 -1.052 . . . . 0.0 112.138 164.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.4 -53.28 47.05 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.374 1.47 . . . . 0.0 111.921 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -64.17 -12.7 42.65 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.221 1.408 . . . . 0.0 114.15 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -123.23 -47.05 2.03 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.745 1.157 . . . . 0.0 114.002 -164.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.58 -17.06 61.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.526 1.13 . . . . 0.0 112.922 168.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 71.2 74.12 0.18 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.667 2.787 . . . . 0.0 111.191 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -142.3 175.44 9.76 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.367 1.867 . . . . 0.0 109.654 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -99.27 148.96 23.6 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 121.658 -0.652 . . . . 0.0 110.324 162.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 tt -42.83 -48.13 5.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.184 1.393 . . . . 0.0 112.937 175.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.09 -41.3 87.74 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -65.16 -34.87 79.41 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.595 -1.316 . . . . 0.0 111.646 175.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.0 mt -74.6 -42.51 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 118.703 -0.665 . . . . 0.0 112.177 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -52.49 -52.65 53.35 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.249 1.42 . . . . 0.0 111.882 170.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.82 -43.66 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 123.895 0.878 . . . . 0.0 110.693 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 84.4 t90 -55.87 -53.07 61.27 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.99 1.268 . . . . 0.0 112.496 172.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -59.03 -47.48 85.07 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 118.704 0.684 . . . . 0.0 111.671 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -47.22 83.84 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.288 0.949 . . . . 0.0 111.573 176.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -63.03 -39.4 94.64 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.986 1.266 . . . . 0.0 112.515 177.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.98 -54.63 42.51 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.74 -1.225 . . . . 0.0 112.547 168.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -28.75 67.17 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.276 1.43 . . . . 0.0 113.718 -175.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.841 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 167.665 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 120.948 0.404 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -75.79 152.5 37.32 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.515 -0.741 . . . . 0.0 110.434 164.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.09 -25.96 64.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -72.06 -3.07 20.87 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.981 1.719 . . . . 0.0 114.573 171.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -110.08 -33.41 6.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.635 1.974 . . . . 0.0 111.405 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mm -63.04 -44.53 99.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.595 0 CA-C-O 117.649 -1.167 . . . . 0.0 111.44 170.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -54.63 -43.89 72.67 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.69 1.586 . . . . 0.0 113.763 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 39.4 t -66.87 -39.98 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.091 0.859 . . . . 0.0 110.47 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.21 -46.35 64.71 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.461 1.105 . . . . 0.0 112.403 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -64.31 -36.13 83.12 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.775 -1.203 . . . . 0.0 112.609 171.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -59.34 -46.34 88.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.659 1.118 . . . . 0.0 112.601 169.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 87.8 t -64.76 -43.25 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 121.256 -0.903 . . . . 0.0 111.241 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -54.86 -43.0 72.72 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.704 1.138 . . . . 0.0 112.63 174.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -63.9 -13.1 42.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.362 2.265 . . . . 0.0 114.525 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.35 -41.96 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.955 1.702 . . . . 0.0 111.476 169.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -143.87 104.13 4.13 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.414 2.286 . . . . 0.0 110.234 -174.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 72.0 m -57.49 -22.26 42.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -158.78 82.47 2.62 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.702 2.001 . . . . 0.0 110.181 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.41 177.9 8.04 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.335 2.69 . . . . 0.0 111.956 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.43 167.31 54.81 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 121.785 -0.572 . . . . 0.0 114.337 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.1 mm -58.3 -47.34 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.802 0 C-N-CA 124.148 0.979 . . . . 0.0 111.667 -173.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -62.59 -26.13 68.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.132 0.973 . . . . 0.0 112.767 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.3 mm -74.47 -44.86 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.654 1.182 . . . . 0.0 110.285 172.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.3 mt -63.27 -39.77 95.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.878 0.871 . . . . 0.0 111.544 173.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -74.01 -33.82 63.94 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.181 1.393 . . . . 0.0 114.458 175.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.73 -41.8 91.72 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.932 1.696 . . . . 0.0 112.158 166.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -61.78 -51.29 68.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.321 0.648 . . . . 0.0 111.402 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.74 -44.06 66.17 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.209 1.004 . . . . 0.0 112.533 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -20.48 27.95 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.644 1.977 . . . . 0.0 114.864 177.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -118.31 -36.98 3.42 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.919 1.236 . . . . 0.0 113.53 -176.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.7 mt -73.61 -9.55 58.79 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.1 1.36 . . . . 0.0 113.456 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 48.26 77.29 0.1 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.509 2.324 . . . . 0.0 112.425 -165.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.86 -179.46 5.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.085 2.554 . . . . 0.0 108.35 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -112.59 159.59 18.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.693 1.597 . . . . 0.0 111.623 164.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.63 -46.67 40.18 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.077 1.351 . . . . 0.0 111.981 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -54.95 -53.42 55.85 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.81 1.244 . . . . 0.0 113.653 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -68.0 -31.8 71.75 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.092 0.86 . . . . 0.0 111.923 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -42.28 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.378 0.99 . . . . 0.0 111.029 169.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -57.74 -54.22 49.36 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.844 1.258 . . . . 0.0 112.019 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.53 -35.69 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.199 -0.938 . . . . 0.0 111.222 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -59.46 -56.45 21.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.724 1.602 . . . . 0.0 112.369 170.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.66 -43.23 94.0 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.858 0.863 . . . . 0.0 111.991 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -55.85 -47.63 76.94 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.854 1.262 . . . . 0.0 110.284 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -74.84 3.3 8.37 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 174.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.41 -64.27 1.17 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 109.921 152.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -45.3 72.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.722 1.209 . . . . 0.0 112.951 -172.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.014 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.776 0 CA-C-O 121.158 0.504 . . . . 0.0 112.229 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.9 t -59.34 146.52 39.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 0.0 111.078 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -55.67 -36.82 67.5 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.495 -0.753 . . . . 0.0 112.981 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -16.31 45.0 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.466 1.107 . . . . 0.0 113.192 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -99.09 -46.45 5.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.006 1.722 . . . . 0.0 111.132 170.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 mm -47.85 -49.09 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.635 1.174 . . . . 0.0 111.848 174.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.95 -31.03 38.18 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.861 1.264 . . . . 0.0 113.674 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.8 t -71.66 -42.94 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 120.844 -1.16 . . . . 0.0 111.232 175.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 mp -67.23 -47.52 70.56 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.647 0.779 . . . . 0.0 111.474 175.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.19 -47.76 65.38 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.688 1.195 . . . . 0.0 111.403 170.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -55.51 -41.7 73.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.08 -47.46 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.497 1.044 . . . . 0.0 111.521 171.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -60.0 -24.01 64.13 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.861 1.664 . . . . 0.0 114.148 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -58.32 -52.3 66.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.523 1.129 . . . . 0.0 111.465 167.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.9 t -75.03 -46.7 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.701 1.6 . . . . 0.0 111.902 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -138.12 112.11 8.45 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.941 0.897 . . . . 0.0 111.455 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.7 p -72.94 -14.71 61.51 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -132.43 76.91 71.29 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.516 2.326 . . . . 0.0 110.494 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.02 159.23 54.79 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.566 2.177 . . . . 0.0 112.547 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.68 166.76 52.41 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 123.725 0.678 . . . . 0.0 112.136 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -64.12 -35.04 72.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 121.803 -0.822 . . . . 0.0 110.698 -174.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.53 -23.96 63.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.975 1.31 . . . . 0.0 113.143 175.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.8 mt -82.89 -37.44 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.152 0.981 . . . . 0.0 109.721 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 39.4 mt -63.06 -47.88 81.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.874 0.869 . . . . 0.0 111.041 167.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -64.72 -35.75 82.06 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 172.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -53.67 -51.89 61.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.946 1.703 . . . . 0.0 110.982 166.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -57.9 -45.7 86.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 173.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.82 -53.22 59.32 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.999 0.818 . . . . 0.0 112.163 175.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -69.8 -27.84 65.23 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.9 1.28 . . . . 0.0 113.553 -174.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -92.94 -24.21 18.48 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.117 1.326 . . . . 0.0 114.455 177.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.2 mt -93.83 -17.38 23.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.28 66.14 0.64 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.454 1.901 . . . . 0.0 111.759 -166.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.46 -175.62 3.64 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.533 2.333 . . . . 0.0 108.953 167.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 pm0 -119.07 153.39 34.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.091 1.756 . . . . 0.0 111.776 169.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.27 -46.48 35.89 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.329 1.852 . . . . 0.0 112.292 -173.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -51.64 -43.77 62.74 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.53 1.532 . . . . 0.0 114.469 175.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -66.61 -41.6 88.16 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.291 -0.88 . . . . 0.0 111.086 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -38.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 118.235 0.47 . . . . 0.0 111.422 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -60.77 -52.5 64.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.07 1.348 . . . . 0.0 111.852 173.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.67 -43.86 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.39 -0.819 . . . . 0.0 110.597 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.405 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 66.7 t90 -58.97 -56.65 19.5 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.617 1.099 . . . . 0.0 112.249 176.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -63.81 -39.52 94.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.119 0.872 . . . . 0.0 112.675 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -62.52 -47.83 82.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.599 1.091 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -60.18 -42.19 94.5 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.797 1.18 . . . . 0.0 111.771 174.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.405 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -62.45 -52.08 64.95 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.063 0.945 . . . . 0.0 113.05 178.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -41.83 98.27 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 117.099 -1.429 . . . . 0.0 111.142 176.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.774 0 CA-C-N 119.576 1.08 . . . . 0.0 112.345 172.759 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.0 t -63.14 147.99 49.26 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.479 -0.763 . . . . 0.0 110.397 160.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -53.02 -34.14 54.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.407 172.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -26.67 64.43 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.512 1.051 . . . . 0.0 112.909 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -82.67 -53.48 5.89 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 126.175 1.79 . . . . 0.0 110.12 171.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.7 mm -53.48 -44.15 55.08 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 C-N-CA 125.101 1.36 . . . . 0.0 111.328 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -54.23 -40.9 68.12 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.805 1.184 . . . . 0.0 112.578 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.39 -46.31 90.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.452 -1.405 . . . . 0.0 110.768 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.3 mp -61.74 -48.89 78.66 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 174.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.21 -52.05 60.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.992 1.717 . . . . 0.0 112.669 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -71.92 -20.33 61.78 Favored 'General case' 0 CA--C 1.553 1.082 0 CA-C-N 119.098 0.863 . . . . 0.0 112.396 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.7 t -68.0 -55.3 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 119.876 1.217 . . . . 0.0 111.329 161.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -53.85 -38.92 65.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.758 1.623 . . . . 0.0 112.775 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.4 ttt85 -56.16 -24.38 40.88 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 127.102 2.161 . . . . 0.0 114.768 172.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.82 -26.36 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 126.111 1.764 . . . . 0.0 112.524 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -135.48 96.12 3.4 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.367 1.467 . . . . 0.0 111.18 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 71.6 m -64.89 -9.97 25.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.067 1.747 . . . . 0.0 114.876 -176.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -157.51 88.96 2.48 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 126.537 1.935 . . . . 0.0 109.642 169.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.37 161.24 43.12 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.798 1.665 . . . . 0.0 112.196 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.04 166.33 48.34 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.625 0.631 . . . . 0.0 113.31 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.12 -43.16 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.052 0.941 . . . . 0.0 112.148 -172.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -70.57 -20.14 62.81 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -176.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.6 mm -79.37 -38.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.52 1.128 . . . . 0.0 110.744 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.8 mt -64.52 -43.94 92.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.84 0.856 . . . . 0.0 111.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -58.64 -50.75 72.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.948 1.699 . . . . 0.0 113.208 167.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -55.09 -42.33 72.73 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.277 1.399 . . . . 0.0 112.249 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 mt -62.77 -46.82 86.24 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.506 -0.746 . . . . 0.0 112.206 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.73 -52.27 66.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.356 0.98 . . . . 0.0 111.817 177.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.36 -44.46 80.13 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.319 1.848 . . . . 0.0 112.616 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -101.89 -15.1 16.97 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -167.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.4 mt -95.31 -5.76 42.78 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.912 1.285 . . . . 0.0 113.039 171.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 53.63 71.3 0.51 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.647 1.979 . . . . 0.0 112.521 -165.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.6 mt -133.41 -178.8 5.15 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.164 2.185 . . . . 0.0 109.558 171.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.59 141.5 47.68 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.155 0.982 . . . . 0.0 110.385 173.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -46.39 -51.94 13.93 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.663 1.585 . . . . 0.0 111.9 -175.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -57.65 -41.97 82.54 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.194 0.998 . . . . 0.0 112.812 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.13 -35.33 80.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.596 -1.315 . . . . 0.0 111.758 174.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.6 mt -73.12 -38.3 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.228 0.922 . . . . 0.0 111.857 175.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -57.67 -56.19 25.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.883 1.22 . . . . 0.0 111.979 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.2 mp -59.26 -37.81 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 117.297 -1.335 . . . . 0.0 110.889 174.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 80.7 t90 -55.58 -63.83 1.04 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.054 1.752 . . . . 0.0 111.164 170.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -55.72 -45.14 78.0 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.685 1.129 . . . . 0.0 112.354 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.96 -37.19 86.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 118.282 -0.866 . . . . 0.0 112.736 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -62.21 -46.69 87.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.178 1.354 . . . . 0.0 111.57 171.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -55.06 -53.76 51.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.086 0.857 . . . . 0.0 111.559 176.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -60.53 -44.85 95.62 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.706 0.802 . . . . 0.0 112.111 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 171.101 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 CA--C 1.544 0.74 0 CA-C-O 121.677 0.751 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -73.75 146.17 44.55 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.223 -0.923 . . . . 0.0 110.979 159.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -56.88 -31.59 65.0 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.656 1.183 . . . . 0.0 113.586 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -21.97 63.46 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.188 -0.945 . . . . 0.0 113.071 173.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -75.41 -54.16 7.52 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.767 1.227 . . . . 0.0 108.687 164.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.5 mm -48.64 -50.47 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.003 1.321 . . . . 0.0 112.118 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -59.36 -26.92 65.48 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -64.54 -51.97 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 122.027 2.194 . . . . 0.0 110.471 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.87 -46.08 90.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 112.603 176.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.75 -49.06 66.24 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.779 1.232 . . . . 0.0 113.07 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -65.76 -15.31 62.73 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.5 t -83.43 -50.04 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 119.277 0.944 . . . . 0.0 111.193 161.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -55.5 -38.82 69.66 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.422 . . . . 0.0 113.999 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.61 -7.5 33.47 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.5 t -119.05 -35.18 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.981 1.712 . . . . 0.0 111.727 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -139.73 93.92 2.71 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 128.585 2.754 . . . . 0.0 109.229 179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.9 p -59.0 -26.39 64.47 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -140.88 106.1 6.28 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.43 1.892 . . . . 0.0 108.87 159.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.68 -179.83 5.82 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 123.265 2.643 . . . . 0.0 111.779 174.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.86 167.8 54.35 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.001 0.81 . . . . 0.0 114.299 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.0 mm -61.65 -41.55 90.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.005 0.922 . . . . 0.0 111.669 -176.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.52 -31.0 67.5 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 125.968 1.707 . . . . 0.0 112.832 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.8 mm -76.52 -38.78 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.577 0.751 . . . . 0.0 110.365 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.17 -44.6 96.25 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.539 -0.725 . . . . 0.0 112.063 170.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -65.26 -41.38 94.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.19 1.796 . . . . 0.0 114.34 172.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.66 -43.5 93.41 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.683 1.128 . . . . 0.0 111.736 172.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.1 mt -61.25 -42.03 97.92 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.591 -1.318 . . . . 0.0 111.704 172.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.86 -58.63 7.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.236 1.014 . . . . 0.0 111.239 174.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -64.99 -37.2 86.89 Favored 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -70.41 -41.86 72.38 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.497 -1.377 . . . . 0.0 114.483 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 47.4 mt -90.85 -1.91 57.8 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.112 1.365 . . . . 0.0 112.696 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 48.64 50.51 17.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.07 2.548 . . . . 0.0 113.895 -170.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.0 mt -108.57 171.83 7.19 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.223 1.809 . . . . 0.0 110.037 170.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -93.89 140.01 30.21 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.509 1.147 . . . . 0.0 110.927 159.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -16.01 59.37 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -173.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.33 -43.7 80.92 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.735 1.614 . . . . 0.0 111.355 170.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -63.35 -38.59 91.75 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.719 -1.238 . . . . 0.0 111.491 171.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.6 mt -69.42 -41.32 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.504 175.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -53.85 -52.67 59.68 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.289 0.95 . . . . 0.0 112.387 169.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.06 -42.43 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.302 172.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.1 t90 -56.81 -52.99 62.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 121.013 1.733 . . . . 0.0 112.283 175.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -61.8 -48.54 80.14 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 118.417 0.553 . . . . 0.0 112.239 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -55.48 -39.7 70.74 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.441 1.019 . . . . 0.0 112.136 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -61.31 -43.12 99.39 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.343 -1.473 . . . . 0.0 112.779 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -58.95 6.21 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.148 0.885 . . . . 0.0 111.75 171.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -30.23 71.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.76 0.824 . . . . 0.0 111.715 -172.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.924 . . . . 0.0 112.028 165.663 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 CA--C 1.542 0.641 0 CA-C-O 120.794 0.33 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -66.79 148.83 51.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.878 0.471 . . . . 0.0 110.701 159.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -57.49 -31.65 66.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.902 0.774 . . . . 0.0 112.158 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -14.16 60.22 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -90.32 -43.75 10.14 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.185 1.794 . . . . 0.0 110.738 168.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.7 mm -55.38 -53.64 33.54 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 C-N-CA 125.006 1.323 . . . . 0.0 110.684 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -58.14 -32.15 67.89 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.125 1.329 . . . . 0.0 114.109 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.73 -45.18 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 120.086 1.312 . . . . 0.0 110.425 173.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.59 -48.06 76.35 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.782 1.233 . . . . 0.0 112.042 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.76 -45.21 78.13 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.964 1.705 . . . . 0.0 111.628 170.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -61.9 -27.09 68.56 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.55 -47.8 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 CA-C-N 120.082 1.31 . . . . 0.0 111.643 166.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -54.91 -32.77 61.43 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.561 1.073 . . . . 0.0 113.027 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -57.23 -25.63 59.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.061 2.545 . . . . 0.0 115.021 171.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.35 -31.03 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.173 1.389 . . . . 0.0 114.263 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -131.71 76.39 1.71 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.536 1.934 . . . . 0.0 109.423 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.1 p -59.71 -27.02 66.09 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -128.79 106.64 18.51 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 126.345 1.858 . . . . 0.0 108.452 156.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.15 -172.3 1.41 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.482 3.455 . . . . 0.0 112.462 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.66 164.81 33.16 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.351 0.977 . . . . 0.0 113.011 167.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 24.9 mm -64.19 -38.17 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 121.753 -0.851 . . . . 0.0 111.636 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.26 -28.07 68.91 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.823 0.849 . . . . 0.0 112.936 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 24.6 mm -79.53 -37.93 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.474 1.51 . . . . 0.0 110.413 175.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.5 mt -61.44 -49.96 74.72 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.134 168.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.08 -46.65 78.95 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.287 1.435 . . . . 0.0 113.38 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.401 ' CG ' ' HZ1' ' A' ' 37' ' ' LYS . 24.1 t70 -65.04 -38.4 90.74 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 178.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -65.98 -46.92 76.29 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.652 -0.655 . . . . 0.0 111.311 170.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.05 -47.81 77.21 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.759 1.223 . . . . 0.0 111.951 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -52.41 -69.48 0.11 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 0.0 111.561 167.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.401 ' HZ1' ' CG ' ' A' ' 33' ' ' ASP . 63.0 mttt -66.85 -18.87 65.59 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -166.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.0 mt -102.34 -2.89 28.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.294 1.438 . . . . 0.0 113.455 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 45.74 62.18 2.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.169 2.187 . . . . 0.0 112.31 -169.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.6 mt -144.41 114.27 7.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.613 1.965 . . . . 0.0 109.029 179.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 pm0 -60.37 150.67 30.02 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.353 0.979 . . . . 0.0 113.233 -174.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.8 -33.61 49.77 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 124.629 1.172 . . . . 0.0 113.578 -171.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -55.89 -48.83 74.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.728 1.611 . . . . 0.0 112.057 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -62.9 -44.79 95.16 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.482 -1.386 . . . . 0.0 111.706 175.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 34.6 mm -67.29 -35.16 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.659 0.663 . . . . 0.0 111.673 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -57.7 -57.92 10.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.22 1.408 . . . . 0.0 111.41 168.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.0 -32.33 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.435 1.016 . . . . 0.0 111.627 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -63.07 -56.15 19.37 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.459 -1.4 . . . . 0.0 112.196 171.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -58.62 -42.36 88.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.983 0.81 . . . . 0.0 111.962 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -53.85 -55.24 28.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.219 1.407 . . . . 0.0 111.055 171.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -73.98 10.9 1.02 Allowed 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.74 -61.03 1.45 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.577 1.951 . . . . 0.0 110.141 159.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -45.31 89.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.952 1.301 . . . . 0.0 112.744 -178.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 123.346 0.658 . . . . 0.0 112.578 174.878 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 122.387 1.089 . . . . 0.0 112.666 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -72.62 147.19 46.04 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.089 -1.007 . . . . 0.0 111.282 163.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -57.01 -36.87 70.93 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.61 -9.06 23.67 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.21 -46.12 6.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.405 1.882 . . . . 0.0 111.656 162.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mm -52.68 -43.25 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.171 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -60.25 -36.81 78.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.69 1.196 . . . . 0.0 113.276 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -48.15 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.16 0.891 . . . . 0.0 110.003 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.02 -46.19 90.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.599 1.159 . . . . 0.0 111.839 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.58 -41.67 97.74 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.697 1.199 . . . . 0.0 113.318 171.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.8 -42.28 79.25 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.845 1.657 . . . . 0.0 113.347 172.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.13 -50.22 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.411 1.005 . . . . 0.0 111.006 172.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -57.79 -33.93 69.07 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.798 1.639 . . . . 0.0 113.912 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -55.6 -52.45 63.75 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.213 2.205 . . . . 0.0 110.713 173.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.6 t -72.02 -42.28 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.474 1.51 . . . . 0.0 112.151 178.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -146.16 110.96 5.22 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.688 1.195 . . . . 0.0 112.887 -176.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 82.6 m -57.49 -24.66 57.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.333 1.453 . . . . 0.0 114.779 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -134.5 92.05 20.92 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.933 1.293 . . . . 0.0 112.237 -174.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -70.16 178.07 5.21 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.587 2.858 . . . . 0.0 113.471 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.4 -178.69 21.27 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 126.177 1.846 . . . . 0.0 112.628 169.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.32 -51.68 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.711 0.804 . . . . 0.0 111.414 -173.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -29.89 71.06 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.592 1.157 . . . . 0.0 112.305 -176.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.7 mt -71.74 -43.81 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.751 0.82 . . . . 0.0 109.555 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.21 -43.94 96.72 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.605 -0.684 . . . . 0.0 111.952 172.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.23 -35.87 80.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.654 1.181 . . . . 0.0 113.901 174.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -61.98 -47.3 85.42 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.117 1.326 . . . . 0.0 111.728 169.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.22 -48.44 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.669 0.787 . . . . 0.0 111.243 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.82 -56.03 21.25 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.451 1.1 . . . . 0.0 111.734 172.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -53.76 -23.73 12.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.203 1.801 . . . . 0.0 113.623 176.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -107.69 -2.7 19.88 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.976 1.71 . . . . 0.0 115.289 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.1 mt -134.5 -13.52 2.3 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -173.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.1 29.22 4.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.505 1.922 . . . . 0.0 114.853 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.3 mt -95.9 166.84 11.59 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.597 1.559 . . . . 0.0 110.985 160.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.07 153.47 21.24 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.428 1.108 . . . . 0.0 112.877 159.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 tt -51.03 -39.1 55.08 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.237 1.415 . . . . 0.0 113.462 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.03 -41.08 77.95 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.538 1.517 . . . . 0.0 112.834 175.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.99 -30.03 61.06 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.773 -1.204 . . . . 0.0 111.667 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 36.5 mt -73.88 -39.35 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.513 0.725 . . . . 0.0 111.588 169.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -51.68 -56.82 11.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.816 1.247 . . . . 0.0 111.292 167.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.6 mt -58.61 -34.72 52.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.709 0.804 . . . . 0.0 112.056 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 79.1 t90 -61.92 -57.68 10.83 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.366 1.439 . . . . 0.0 110.953 171.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -58.68 -42.81 89.39 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -55.26 -53.06 60.87 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.338 1.055 . . . . 0.0 111.626 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -61.97 -48.38 80.63 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.949 1.25 . . . . 0.0 111.689 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -65.68 -35.38 80.61 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.206 -0.934 . . . . 0.0 113.309 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -43.24 67.4 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.106 1.321 . . . . 0.0 111.753 170.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 179.781 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.508 ' H ' HD13 ' A' ' 13' ' ' ILE . 5.9 m-85 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 121.053 0.454 . . . . 0.0 110.534 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.6 t -73.46 145.92 45.36 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.555 1.142 . . . . 0.0 111.504 168.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -55.82 -37.39 68.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.567 1.076 . . . . 0.0 113.717 -172.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -27.98 65.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 120.447 1.476 . . . . 0.0 112.719 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -82.22 -49.8 9.71 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.819 1.247 . . . . 0.0 111.041 169.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.508 HD13 ' H ' ' A' ' 8' ' ' PHE . 20.4 mm -49.93 -46.56 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 118.064 -0.97 . . . . 0.0 112.447 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.56 -27.88 66.63 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.579 1.081 . . . . 0.0 113.147 -177.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.58 -50.89 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.8 1.182 . . . . 0.0 110.364 171.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.5 -43.75 93.13 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -56.67 -41.35 77.12 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.394 1.452 . . . . 0.0 111.671 170.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -58.12 -38.34 76.31 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.452 1.024 . . . . 0.0 113.661 172.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.96 -45.38 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.177 0.899 . . . . 0.0 111.356 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -59.12 -30.1 67.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.502 1.121 . . . . 0.0 113.953 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.7 mtp85 -57.04 -54.94 41.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.543 1.137 . . . . 0.0 112.205 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.5 m -79.5 -31.62 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -131.62 85.54 2.26 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.335 2.254 . . . . 0.0 111.229 -176.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -60.0 -30.72 69.32 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -129.63 102.83 17.88 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 126.591 1.957 . . . . 0.0 108.106 164.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -78.96 -175.93 3.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.914 3.076 . . . . 0.0 112.917 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.9 167.68 18.65 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 126.111 1.815 . . . . 0.0 113.201 167.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.4 mm -64.82 -35.52 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.498 1.119 . . . . 0.0 112.568 -171.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -64.73 -32.32 73.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.139 0.975 . . . . 0.0 112.881 176.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 mm -71.72 -37.48 62.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.863 0.865 . . . . 0.0 110.563 172.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 89.9 mt -67.14 -47.68 70.36 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.75 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.63 -53.65 44.13 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 120.02 1.282 . . . . 0.0 113.399 167.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.95 -42.88 80.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.894 1.679 . . . . 0.0 112.61 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.71 -44.97 95.95 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.114 -0.991 . . . . 0.0 112.689 172.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.44 -58.67 6.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.318 1.047 . . . . 0.0 111.395 173.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -53.9 -44.18 70.3 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.11 1.364 . . . . 0.0 112.928 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -86.05 -6.58 59.0 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.2 mt -121.93 2.95 9.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.045 1.338 . . . . 0.0 113.45 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 t30 61.0 24.38 14.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.049 2.139 . . . . 0.0 114.039 -177.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.7 mt -95.85 173.09 7.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.345 2.258 . . . . 0.0 109.868 174.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -111.06 162.48 14.84 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.284 1.033 . . . . 0.0 113.337 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.6 tp -48.06 -48.07 33.47 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.504 1.522 . . . . 0.0 112.522 -176.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -60.49 -39.72 88.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.379 1.072 . . . . 0.0 112.319 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -61.93 -40.68 96.33 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.885 1.22 . . . . 0.0 111.102 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -40.41 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 118.693 0.679 . . . . 0.0 111.23 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.83 -55.62 24.94 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.268 1.027 . . . . 0.0 112.23 169.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.81 -39.25 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.411 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -60.66 -50.51 73.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.824 1.647 . . . . 0.0 111.797 175.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -65.65 -41.34 92.68 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.942 0.792 . . . . 0.0 111.769 178.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -60.4 -40.13 89.84 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.955 1.252 . . . . 0.0 111.997 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.84 -52.01 66.79 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.799 1.181 . . . . 0.0 111.702 169.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -44.86 94.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -35.11 73.02 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.784 -1.198 . . . . 0.0 111.709 175.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.545 0 CA-C-N 119.704 1.138 . . . . 0.0 111.92 168.612 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.401 ' H ' HD13 ' A' ' 13' ' ' ILE . 8.8 m-85 . . . . . 0 CA--C 1.546 0.797 0 CA-C-O 120.79 0.329 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.6 t -73.16 150.88 41.8 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.701 0.8 . . . . 0.0 111.197 155.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.31 -33.27 74.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -167.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.91 -14.89 62.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.581 1.537 . . . . 0.0 113.198 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -78.39 -50.05 12.43 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.908 -1.12 . . . . 0.0 110.446 162.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.417 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 19.3 mm -48.34 -50.07 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.996 0.918 . . . . 0.0 112.051 175.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -60.6 -25.4 66.21 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.6 t -69.1 -43.42 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 120.078 1.308 . . . . 0.0 110.662 172.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 mp -65.82 -46.58 78.08 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.431 174.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -52.9 -47.2 68.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.716 1.143 . . . . 0.0 113.482 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -64.62 -27.2 68.77 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.4 t -71.99 -44.42 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.263 0.938 . . . . 0.0 111.508 164.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -56.42 -37.11 69.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.33 1.452 . . . . 0.0 113.353 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -69.91 -0.06 6.72 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.2 t -119.05 -37.29 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.069 1.748 . . . . 0.0 111.304 173.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -130.7 88.52 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.298 2.239 . . . . 0.0 110.163 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.73 -33.1 75.1 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.94 0.896 . . . . 0.0 112.77 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -122.78 87.97 50.18 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.901 1.68 . . . . 0.0 108.956 165.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -61.58 162.21 21.93 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.699 2.266 . . . . 0.0 114.538 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.73 164.08 44.64 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.017 0.818 . . . . 0.0 112.4 162.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.95 -39.1 70.23 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.817 0 C-N-CA 124.73 1.212 . . . . 0.0 111.103 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.31 -29.38 64.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.43 1.892 . . . . 0.0 112.972 -176.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.3 mt -69.58 -45.32 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 123.669 0.788 . . . . 0.0 109.168 170.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 14.9 mt -64.0 -43.37 95.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.553 0.741 . . . . 0.0 111.134 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.21 -35.99 80.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.446 1.498 . . . . 0.0 114.244 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.32 -44.97 93.42 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.706 -1.246 . . . . 0.0 112.05 168.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.63 -47.84 83.02 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.735 0.698 . . . . 0.0 111.912 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.82 -57.81 7.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 126.019 1.727 . . . . 0.0 111.189 174.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -44.83 84.43 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.529 0.731 . . . . 0.0 112.587 177.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -75.12 -15.85 60.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.572 1.549 . . . . 0.0 114.656 -177.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 88.8 mt -122.77 -2.82 8.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.671 1.189 . . . . 0.0 114.199 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 55.87 56.28 6.19 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.741 2.016 . . . . 0.0 112.565 -174.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 79.9 mt -131.05 156.45 45.16 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.442 2.297 . . . . 0.0 108.691 176.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -85.37 154.19 22.03 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.819 0.736 . . . . 0.0 112.574 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.35 -47.65 6.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.493 1.917 . . . . 0.0 112.658 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.1 -34.73 78.71 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -64.28 -39.22 93.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.678 2.035 . . . . 0.0 111.347 173.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -44.92 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.295 -0.86 . . . . 0.0 111.486 174.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.28 -54.26 47.5 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.579 1.081 . . . . 0.0 111.396 172.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -56.38 -42.33 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 O-C-N 120.559 -1.338 . . . . 0.0 110.739 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . 0.417 ' HE1' ' CD1' ' A' ' 13' ' ' ILE . 81.1 t90 -57.08 -55.84 29.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 120.432 1.469 . . . . 0.0 112.492 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -61.73 -48.03 82.56 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.82 0.848 . . . . 0.0 112.606 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -59.0 -40.93 86.4 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 120.18 1.355 . . . . 0.0 111.884 174.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -62.59 -38.02 88.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.116 1.326 . . . . 0.0 111.605 172.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -52.71 60.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.053 0.941 . . . . 0.0 112.744 174.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -36.58 84.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.344 1.058 . . . . 0.0 111.71 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 118.587 0.63 . . . . 0.0 111.299 164.427 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 . . . . . 0 CA--C 1.539 0.558 0 CA-C-O 122.144 0.973 . . . . 0.0 113.21 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.6 p -79.52 151.31 30.82 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.383 2.273 . . . . 0.0 111.285 171.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -56.75 -45.24 82.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -167.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.24 -21.38 63.82 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 121.578 1.99 . . . . 0.0 113.633 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -85.12 -38.59 18.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.794 1.238 . . . . 0.0 112.133 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 37.7 mm -57.7 -50.95 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.748 0.819 . . . . 0.0 111.392 171.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -66.05 -19.05 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -176.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 87.7 t -78.21 -42.77 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 120.384 -1.447 . . . . 0.0 110.653 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 71.8 mt -67.96 -48.91 64.55 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.488 1.115 . . . . 0.0 112.337 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -55.9 -40.52 73.17 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.768 1.227 . . . . 0.0 112.074 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -63.22 -25.35 68.29 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 174.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.59 -45.28 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.922 1.237 . . . . 0.0 111.215 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -53.9 -41.97 68.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.624 1.102 . . . . 0.0 112.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -6.36 23.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 175.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 61.0 t -110.58 -38.16 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.739 2.016 . . . . 0.0 111.303 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -141.36 97.41 3.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.107 2.163 . . . . 0.0 109.307 172.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 16.6 p -55.48 -33.21 63.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.936 0.894 . . . . 0.0 112.755 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.96 103.65 39.57 Favored Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 125.66 1.584 . . . . 0.0 109.39 161.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.64 179.93 5.13 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 124.201 3.267 . . . . 0.0 112.791 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.68 165.14 41.96 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.586 -0.696 . . . . 0.0 111.633 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -68.13 -36.36 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.595 1.198 . . . . 0.0 110.659 177.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.99 -36.32 74.71 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 170.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -73.47 -38.72 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.65 0.659 . . . . 0.0 110.378 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.17 -46.73 85.75 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.291 -0.88 . . . . 0.0 111.867 171.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.09 -51.12 67.39 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.749 1.619 . . . . 0.0 112.833 168.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -61.15 -41.62 97.08 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.412 1.005 . . . . 0.0 112.906 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -62.89 -45.83 90.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.572 0.749 . . . . 0.0 111.537 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.86 -53.07 62.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.062 0.945 . . . . 0.0 110.865 175.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -53.49 -40.45 65.35 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.822 1.649 . . . . 0.0 113.278 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.76 -12.74 18.1 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -174.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.1 mt -99.69 -4.84 29.92 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.37 1.068 . . . . 0.0 112.634 172.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.62 55.83 6.07 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.023 1.329 . . . . 0.0 110.819 -172.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.9 mt -126.11 177.8 6.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.981 2.112 . . . . 0.0 109.333 171.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -104.1 162.06 13.48 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.865 -1.147 . . . . 0.0 112.655 161.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.81 -50.37 7.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.861 2.064 . . . . 0.0 112.0 173.117 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -58.64 -47.63 83.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.804 1.641 . . . . 0.0 114.126 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -63.94 -36.8 85.16 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 120.802 -1.186 . . . . 0.0 111.587 179.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.34 -42.09 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 118.512 -0.756 . . . . 0.0 112.313 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -52.13 -52.11 53.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.505 1.048 . . . . 0.0 111.434 169.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -59.1 -43.59 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 117.655 -1.164 . . . . 0.0 110.714 175.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 76.1 t90 -57.7 -55.1 39.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.959 1.709 . . . . 0.0 112.48 173.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -59.06 -46.57 87.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.342 0.973 . . . . 0.0 111.918 -177.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -65.04 -42.11 94.58 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.444 -0.785 . . . . 0.0 112.149 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -61.21 -38.33 86.22 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.391 1.451 . . . . 0.0 112.227 171.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -58.3 9.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.596 1.158 . . . . 0.0 112.929 173.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -41.33 84.16 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 119.749 1.159 . . . . 0.0 111.738 177.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 172.398 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 120.991 0.424 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.0 t -62.65 144.39 56.32 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 121.338 -0.851 . . . . 0.0 109.938 158.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -56.05 -34.47 65.93 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.732 1.213 . . . . 0.0 112.909 176.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -70.72 -1.31 11.01 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 126.177 1.791 . . . . 0.0 113.991 173.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -104.25 -48.88 3.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.613 1.565 . . . . 0.0 110.116 159.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.5 mm -46.52 -46.06 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 124.627 1.171 . . . . 0.0 112.571 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -53.13 -38.08 62.36 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.3 t -66.22 -49.09 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 120.357 1.435 . . . . 0.0 109.985 176.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.24 -45.45 93.2 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.14 0.576 . . . . 0.0 112.55 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -61.16 -45.08 96.11 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 120.83 -1.169 . . . . 0.0 114.087 172.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -64.5 -25.82 68.16 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 120.65 1.568 . . . . 0.0 113.443 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.6 t -70.34 -53.56 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 120.254 1.388 . . . . 0.0 110.841 165.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -54.83 -30.46 57.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.91 1.284 . . . . 0.0 113.604 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -62.05 -23.12 66.29 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 128.325 2.65 . . . . 0.0 114.389 173.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.9 t -119.53 -30.26 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.91 1.684 . . . . 0.0 112.104 -173.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -142.77 96.99 3.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.317 1.447 . . . . 0.0 110.27 165.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -70.64 -8.28 50.58 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -145.77 76.2 12.88 Favored Pre-proline 0 CA--C 1.548 0.882 0 CA-C-N 119.334 0.97 . . . . 0.0 111.29 174.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -79.35 -173.38 1.85 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.108 3.205 . . . . 0.0 114.006 -170.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -94.89 173.33 31.85 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.46 1.505 . . . . 0.0 113.74 174.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.56 -41.37 92.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 C-N-CA 123.806 0.842 . . . . 0.0 111.988 -175.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.43 -36.95 72.04 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.972 0.909 . . . . 0.0 112.912 176.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.17 -42.15 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.106 0.866 . . . . 0.0 110.072 174.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 67.4 mt -62.55 -46.29 89.04 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 118.869 -0.586 . . . . 0.0 112.214 173.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -62.88 -43.8 97.82 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.776 1.631 . . . . 0.0 113.964 175.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.73 -35.54 81.41 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.275 1.398 . . . . 0.0 112.003 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -66.11 -50.4 64.16 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.271 -0.893 . . . . 0.0 111.89 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.45 -43.37 71.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.382 1.473 . . . . 0.0 112.252 177.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -56.29 -69.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.752 1.221 . . . . 0.0 112.016 167.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -69.08 -15.15 63.38 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -168.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.0 mt -120.71 3.48 10.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.976 1.311 . . . . 0.0 114.376 -176.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.77 71.92 0.48 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.993 2.117 . . . . 0.0 113.716 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.8 mt -141.38 165.7 26.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.95 2.1 . . . . 0.0 109.643 170.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.24 147.11 31.36 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.888 -1.133 . . . . 0.0 112.077 158.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -49.99 -35.54 24.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.989 0.916 . . . . 0.0 113.199 172.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.76 -42.2 75.11 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 112.381 174.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -74.97 -32.12 61.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.173 -0.955 . . . . 0.0 113.319 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 4.1 mm -66.72 -39.86 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.543 1.065 . . . . 0.0 111.298 168.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.81 -58.67 7.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.958 1.303 . . . . 0.0 110.716 171.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.5 mt -54.1 -38.51 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.524 1.056 . . . . 0.0 111.469 175.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.66 -59.45 5.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 120.193 1.36 . . . . 0.0 112.956 172.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -58.96 -43.39 91.3 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.139 0.882 . . . . 0.0 111.959 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -64.43 -42.87 95.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 111.644 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -62.54 -38.43 89.97 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.645 1.566 . . . . 0.0 111.713 172.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -61.54 2.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.544 1.138 . . . . 0.0 112.328 173.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -37.41 86.4 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.491 -0.766 . . . . 0.0 112.02 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.705 0 CA-C-N 119.324 0.965 . . . . 0.0 112.852 172.068 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.913 0 CA-C-O 118.494 -1.17 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 12.37 66.58 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.937 3.695 . . . . 0.0 116.77 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 64.6 mtt-85 -71.66 146.82 91.57 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 123.907 0.883 . . . . 0.0 112.161 -172.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.63 179.14 4.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.448 2.765 . . . . 0.0 111.709 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.93 97.39 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.744 0.818 . . . . 0.0 109.669 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.8 m -75.24 145.08 42.24 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.081 1.752 . . . . 0.0 109.993 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -130.43 164.42 24.79 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.545 1.138 . . . . 0.0 111.259 173.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -131.94 -172.01 2.77 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.984 1.714 . . . . 0.0 111.233 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.0 t -65.87 145.76 55.55 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.153 0.581 . . . . 0.0 110.268 155.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.07 -19.71 63.21 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.089 -1.007 . . . . 0.0 113.121 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.83 -14.22 62.89 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.783 1.233 . . . . 0.0 113.432 170.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -98.16 -43.14 7.12 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.78 2.032 . . . . 0.0 110.13 172.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.3 -46.49 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.093 0.957 . . . . 0.0 110.913 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.34 69.2 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.91 -46.5 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 120.022 1.283 . . . . 0.0 109.638 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.32 -45.32 91.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.458 1.103 . . . . 0.0 112.206 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -48.62 -58.74 4.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.674 1.59 . . . . 0.0 113.009 166.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -68.06 -19.26 64.86 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -174.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 71.8 t -73.75 -51.42 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.896 1.278 . . . . 0.0 111.684 162.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -53.84 -30.2 44.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.881 1.673 . . . . 0.0 113.396 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -50.18 -52.94 31.35 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.438 1.017 . . . . 0.0 112.344 167.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.69 -49.45 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 127.982 2.513 . . . . 0.0 111.148 -173.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -131.63 96.52 3.98 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 112.294 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.6 -12.19 14.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.01 -1.056 . . . . 0.0 113.773 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -146.76 103.95 3.92 Favored Pre-proline 0 CA--C 1.547 0.839 0 O-C-N 120.324 -1.485 . . . . 0.0 110.82 160.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -75.77 176.15 10.37 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.674 2.916 . . . . 0.0 113.478 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -100.78 176.93 27.68 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.65 1.595 . . . . 0.0 113.364 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.8 mm -62.5 -39.93 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -65.7 -32.85 74.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.115 0.87 . . . . 0.0 113.045 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.5 mm -71.74 -38.58 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 123.696 0.798 . . . . 0.0 110.679 172.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.31 -47.86 77.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.726 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -41.41 94.41 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.517 1.053 . . . . 0.0 113.478 170.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.426 ' CG ' ' HZ1' ' A' ' 37' ' ' LYS . 39.2 t70 -56.61 -50.44 71.99 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.285 -1.509 . . . . 0.0 112.072 172.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.6 mt -61.54 -42.2 98.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.357 0.663 . . . . 0.0 112.25 174.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -53.5 57.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.674 1.19 . . . . 0.0 112.214 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -65.15 -29.85 70.72 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.426 ' HZ1' ' CG ' ' A' ' 33' ' ' ASP . 85.9 mttt -81.74 -56.45 3.99 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.745 1.218 . . . . 0.0 113.747 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 89.6 mt -74.08 -10.13 59.32 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.341 1.456 . . . . 0.0 113.781 -171.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 48.4 70.27 0.47 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.409 1.884 . . . . 0.0 111.476 -159.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.9 mt -135.24 158.5 44.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.488 1.915 . . . . 0.0 108.573 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -88.02 145.68 25.87 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.266 1.426 . . . . 0.0 110.403 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.3 tt -48.49 -41.29 29.42 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -54.18 -49.22 69.81 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.183 1.393 . . . . 0.0 112.749 175.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -59.9 -40.46 88.86 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.895 -1.128 . . . . 0.0 111.969 175.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -74.95 -34.08 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 118.745 0.702 . . . . 0.0 112.446 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -57.45 -52.46 65.27 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.424 1.011 . . . . 0.0 111.786 167.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -57.8 -37.92 62.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.255 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -61.35 -58.72 7.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 120.83 1.65 . . . . 0.0 112.361 172.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -57.94 -42.06 84.1 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -70.53 -38.84 74.29 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 120.623 -1.298 . . . . 0.0 113.466 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -62.73 -32.77 73.95 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 121.02 1.736 . . . . 0.0 111.985 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -58.81 6.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.582 1.153 . . . . 0.0 113.074 172.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 -56.25 -50.09 72.33 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.363 0.665 . . . . 0.0 111.846 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.12 -47.6 65.23 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.807 1.039 . . . . 0.0 113.807 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.54 -48.47 81.62 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.189 -0.944 . . . . 0.0 112.323 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.5 tp -59.35 -37.12 77.04 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.545 1.138 . . . . 0.0 113.076 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -67.45 -43.95 79.84 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.692 0.797 . . . . 0.0 112.484 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 71.82 -41.36 0.5 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 128.674 2.79 . . . . 0.0 114.997 170.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 p -136.07 163.04 31.25 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.609 1.964 . . . . 0.0 111.0 165.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.1 m80 64.77 173.03 0.2 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 128.138 2.575 . . . . 0.0 114.811 -177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -158.26 150.21 21.66 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.834 2.454 . . . . 0.0 110.706 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -50.72 -67.0 0.29 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.442 1.497 . . . . 0.0 113.213 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.9 t -73.49 25.71 0.07 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.48 1.512 . . . . 0.0 113.338 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -140.9 155.51 46.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.877 1.671 . . . . 0.0 111.306 -171.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -153.41 -54.44 0.11 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.288 1.835 . . . . 0.0 109.35 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.4 tp 58.73 -49.06 0.06 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 129.108 2.963 . . . . 0.0 114.356 -166.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 C--O 1.249 1.072 0 C-N-CA 127.75 2.42 . . . . 0.0 111.895 -177.117 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 CA-C-O 119.091 -0.838 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -63.19 89.97 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.572 2.349 . . . . 0.0 111.501 178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 33.8 ttt85 -153.54 135.53 9.08 Favored Pre-proline 0 N--CA 1.475 0.781 0 C-N-CA 124.609 1.163 . . . . 0.0 111.246 -166.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -77.3 54.28 4.61 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 124.05 3.167 . . . . 0.0 114.271 -176.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.2 ttt85 -148.87 129.2 13.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.512 1.525 . . . . 0.0 110.415 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -112.12 -15.99 13.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.682 1.593 . . . . 0.0 112.28 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.05 93.83 0.21 Allowed 'General case' 0 CA--C 1.547 0.833 0 O-C-N 119.921 -1.737 . . . . 0.0 111.915 165.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -66.38 -167.38 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 129.289 3.036 . . . . 0.0 115.238 -176.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.2 t -67.86 140.79 56.56 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.918 1.687 . . . . 0.0 110.488 162.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.54 -32.84 65.52 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -61.96 -33.69 74.75 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.0 1.273 . . . . 0.0 113.461 175.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.09 -40.63 45.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.726 1.21 . . . . 0.0 111.403 174.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.61 -56.21 16.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.638 0 CA-C-N 118.518 0.599 . . . . 0.0 110.616 173.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.7 -10.64 57.56 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.6 t -82.25 -52.23 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.156 0.983 . . . . 0.0 110.838 161.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -57.62 -48.1 80.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.33 1.052 . . . . 0.0 112.797 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -58.31 -38.82 77.84 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.14 1.376 . . . . 0.0 112.444 171.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -60.47 -32.53 71.49 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.9 t -73.05 -50.96 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.266 0.939 . . . . 0.0 110.559 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -54.87 -28.7 52.12 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.825 1.25 . . . . 0.0 114.01 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -56.13 -63.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.328 1.851 . . . . 0.0 112.374 165.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.6 -35.14 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -141.72 106.24 4.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.22 1.408 . . . . 0.0 111.497 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -61.91 -26.25 68.06 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.898 -1.126 . . . . 0.0 113.344 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -121.77 96.4 47.18 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 127.343 2.257 . . . . 0.0 109.615 166.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -62.52 166.28 13.73 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.32 2.013 . . . . 0.0 111.78 167.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.55 165.27 54.37 Favored Glycine 0 CA--C 1.534 1.242 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 163.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.0 mm -62.07 -32.44 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 O-C-N 121.705 -0.88 . . . . 0.0 111.281 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.58 -29.25 69.83 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.873 1.669 . . . . 0.0 112.655 177.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 52.6 mt -80.5 -38.75 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 123.891 0.876 . . . . 0.0 109.655 174.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.3 mt -63.0 -43.04 99.87 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.487 -0.758 . . . . 0.0 111.649 171.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -55.64 32.28 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.497 -1.24 . . . . 0.0 112.728 164.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -55.67 -39.06 70.44 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.448 1.931 . . . . 0.0 112.889 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.84 -53.79 53.78 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.089 0.956 . . . . 0.0 111.452 170.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.07 -55.85 18.08 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.862 1.21 . . . . 0.0 112.186 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.8 mm-40 -54.91 -40.28 69.68 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.401 1.88 . . . . 0.0 111.808 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -27.13 30.91 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 178.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.9 -19.64 15.18 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 120.026 1.284 . . . . 0.0 114.048 -171.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 62.34 32.42 16.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.194 1.797 . . . . 0.0 113.764 -170.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.2 mt -90.96 171.54 9.21 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.803 150.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.04 163.67 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.333 1.063 . . . . 0.0 112.926 161.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.87 -51.74 4.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.711 2.004 . . . . 0.0 112.143 172.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -53.43 -55.36 25.84 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.202 1.801 . . . . 0.0 114.062 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.7 mtt85 -65.49 -34.41 78.22 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.202 -0.936 . . . . 0.0 111.504 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.2 mt -71.22 -41.19 74.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.033 0.833 . . . . 0.0 112.032 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -57.38 -53.44 58.08 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.155 1.343 . . . . 0.0 110.922 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.3 mt -56.06 -43.14 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.984 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -56.42 -56.56 19.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.349 1.431 . . . . 0.0 112.61 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -56.86 -48.61 77.71 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.596 0.759 . . . . 0.0 112.336 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -63.08 -44.23 96.33 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.018 -0.992 . . . . 0.0 111.181 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -62.85 -34.54 77.58 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.28 1.4 . . . . 0.0 112.78 174.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -65.45 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.837 1.255 . . . . 0.0 112.467 170.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -41.31 82.43 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 119.481 1.037 . . . . 0.0 113.298 177.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.55 -9.61 14.09 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -130.23 7.72 5.04 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.9 tp -51.07 -57.54 8.4 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.534 1.516 . . . . 0.0 111.867 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.82 14.04 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 172.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.5 ttt85 -139.32 17.94 2.58 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.15 1.78 . . . . 0.0 113.71 166.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -96.72 72.5 2.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.583 -1.323 . . . . 0.0 112.044 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -70.95 50.52 0.14 Allowed 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 126.93 2.092 . . . . 0.0 114.982 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -134.59 2.04 3.16 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 128.63 2.772 . . . . 0.0 112.466 172.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.509 ' HG2' ' H ' ' A' ' 64' ' ' GLN . 28.4 tt0 -72.43 159.95 33.13 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.306 -0.871 . . . . 0.0 110.712 163.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.4 m -146.67 35.49 0.95 Allowed 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.641 -1.287 . . . . 0.0 111.155 170.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.509 ' H ' ' HG2' ' A' ' 62' ' ' GLU . 15.3 tp60 -78.7 -66.85 0.81 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.907 1.283 . . . . 0.0 111.001 -177.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -148.22 -81.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.452 0.701 . . . . 0.0 112.128 173.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 tp -162.29 160.75 27.14 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.082 2.553 . . . . 0.0 108.161 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 8.3 ttt . . . . . 0 C--O 1.248 1.01 0 CA-C-N 119.202 0.91 . . . . 0.0 111.747 169.753 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.883 0 N-CA-C 111.066 -0.813 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -133.73 -176.57 4.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.073 2.149 . . . . 0.0 112.519 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 8.83 75.49 0.06 OUTLIER Pre-proline 0 N--CA 1.491 1.62 0 C-N-CA 129.985 3.314 . . . . 0.0 115.559 -173.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -78.5 49.2 2.98 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 124.045 3.163 . . . . 0.0 113.914 -173.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -61.12 103.98 0.33 Allowed 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.646 -1.284 . . . . 0.0 110.185 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.8 m -71.27 135.58 47.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.625 -0.672 . . . . 0.0 110.989 -173.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.16 122.55 25.5 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.053 1.341 . . . . 0.0 110.5 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -94.66 -169.22 1.98 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.98 1.712 . . . . 0.0 112.398 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.0 t -76.31 153.65 35.71 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.188 -0.945 . . . . 0.0 111.657 161.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -53.97 -40.18 66.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 123.852 0.861 . . . . 0.0 112.787 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -63.9 -9.58 16.13 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -101.62 -38.25 8.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.297 1.839 . . . . 0.0 111.807 168.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -55.47 -51.85 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.12 0.968 . . . . 0.0 110.873 172.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -60.48 -29.85 69.32 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -176.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 64.7 t -70.56 -46.66 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 119.28 0.946 . . . . 0.0 110.652 172.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.1 mt -64.19 -46.75 82.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.624 1.17 . . . . 0.0 111.544 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -51.94 -53.27 43.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.702 . . . . 0.0 112.309 165.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -55.41 -30.21 60.01 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 178.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 92.0 t -72.54 -55.16 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 119.609 1.095 . . . . 0.0 111.039 166.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -51.84 -32.02 30.17 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.517 1.527 . . . . 0.0 113.873 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -67.04 -22.91 65.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.418 2.687 . . . . 0.0 114.662 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 m -117.52 -35.75 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.015 1.726 . . . . 0.0 113.096 174.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -114.55 78.32 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.491 1.916 . . . . 0.0 109.379 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.4 m -55.99 -20.37 16.2 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.568 1.547 . . . . 0.0 114.833 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -143.81 98.29 5.29 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.228 1.011 . . . . 0.0 109.678 165.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.91 169.54 20.12 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.45 2.1 . . . . 0.0 111.516 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.49 167.11 33.6 Favored Glycine 0 CA--C 1.532 1.121 0 O-C-N 121.762 -0.586 . . . . 0.0 112.4 169.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.27 -29.96 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 117.944 -1.027 . . . . 0.0 111.993 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -40.04 86.07 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.703 1.592 . . . . 0.0 112.963 171.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mm -69.82 -38.57 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 118.722 0.692 . . . . 0.0 110.929 173.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 79.3 mt -66.57 -45.34 79.62 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.377 -0.827 . . . . 0.0 112.55 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -52.8 -58.21 7.62 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.858 2.063 . . . . 0.0 112.458 165.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.39 -36.4 82.18 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.844 1.202 . . . . 0.0 112.877 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.1 mt -60.42 -48.09 83.28 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.649 1.113 . . . . 0.0 111.938 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.09 -56.23 23.31 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.797 1.239 . . . . 0.0 110.341 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.76 -2.78 1.93 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.557 1.943 . . . . 0.0 115.44 176.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -128.9 -18.34 3.81 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 120.753 1.615 . . . . 0.0 114.885 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -97.41 1.88 49.77 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.05 2.14 . . . . 0.0 111.987 163.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.3 t30 43.57 60.18 2.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 128.485 2.714 . . . . 0.0 113.843 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -119.39 173.76 6.77 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.691 2.796 . . . . 0.0 108.097 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.422 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 4.9 pm0 -96.73 166.62 11.56 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 120.814 -1.179 . . . . 0.0 112.637 164.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.6 tp -52.37 -47.38 66.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.419 177.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -53.46 52.75 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.063 0.847 . . . . 0.0 112.184 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.422 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 53.7 mtt180 -65.52 -30.01 70.71 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.709 1.141 . . . . 0.0 112.354 -173.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.4 mt -78.42 -39.97 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.632 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -54.35 -53.6 51.74 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 120.659 1.572 . . . . 0.0 112.627 170.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.74 -36.16 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 117.304 -1.332 . . . . 0.0 110.81 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -58.93 -61.55 2.55 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.511 1.96 . . . . 0.0 111.77 169.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -55.48 -49.9 71.29 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.087 0.858 . . . . 0.0 112.183 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -60.84 -35.39 76.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.294 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -64.26 -51.96 61.01 Favored 'General case' 0 C--N 1.347 0.5 0 CA-C-N 120.81 1.641 . . . . 0.0 111.604 171.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -58.75 -47.27 85.24 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 120.582 1.537 . . . . 0.0 111.545 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -35.12 79.35 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.94 1.296 . . . . 0.0 113.113 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.66 -49.31 54.88 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.466 1.03 . . . . 0.0 113.479 167.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -54.88 -29.3 55.23 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.385 2.274 . . . . 0.0 112.217 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.48 -51.19 70.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.322 1.449 . . . . 0.0 112.12 170.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.3 -40.16 93.14 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 119.472 1.033 . . . . 0.0 111.871 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -79.79 55.56 2.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.065 1.346 . . . . 0.0 112.145 166.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.5 p -150.09 170.37 19.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.792 1.237 . . . . 0.0 111.035 163.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -143.62 82.08 1.72 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -174.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.25 163.77 32.06 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.258 1.423 . . . . 0.0 109.664 166.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -137.55 146.72 44.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.207 1.803 . . . . 0.0 109.272 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.1 m -109.07 139.0 44.54 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.965 0.906 . . . . 0.0 112.01 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -78.99 131.26 36.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.039 0.535 . . . . 0.0 111.52 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.54 170.59 10.34 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.994 1.718 . . . . 0.0 113.324 -175.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.439 ' HG ' ' H ' ' A' ' 67' ' ' MET . 6.2 tp -137.25 179.58 6.31 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.616 1.566 . . . . 0.0 111.703 -176.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.439 ' H ' ' HG ' ' A' ' 66' ' ' LEU . 90.2 mtp . . . . . 0 C--O 1.249 1.064 0 C-N-CA 125.711 1.605 . . . . 0.0 111.743 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.836 0 N-CA-C 109.189 -1.564 . . . . 0.0 109.189 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -136.38 104.76 5.71 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.196 1.398 . . . . 0.0 109.864 166.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -41.81 131.59 2.42 Favored Pre-proline 0 N--CA 1.483 1.221 0 C-N-CA 126.344 1.858 . . . . 0.0 115.247 -161.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.19 119.77 6.81 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.856 2.371 . . . . 0.0 111.002 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 66.86 126.95 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 128.282 2.633 . . . . 0.0 112.395 -171.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.8 m -56.18 -58.29 8.59 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.58 1.552 . . . . 0.0 113.966 -172.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.31 148.49 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 129.476 3.11 . . . . 0.0 116.629 -172.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -129.21 -169.48 2.1 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.21 2.604 . . . . 0.0 110.2 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.4 t -84.16 147.26 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.087 -1.008 . . . . 0.0 110.249 158.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -57.62 -32.25 67.04 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.67 1.123 . . . . 0.0 112.188 176.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.45 -31.5 62.0 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.461 1.504 . . . . 0.0 113.081 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -88.58 -41.51 12.63 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 126.175 1.79 . . . . 0.0 111.026 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.3 mm -51.99 -47.29 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.819 0.848 . . . . 0.0 110.849 171.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.75 -50.91 17.39 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.8 t -66.59 -41.33 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 O-C-N 121.37 -0.831 . . . . 0.0 111.002 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.07 -46.42 81.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.583 1.153 . . . . 0.0 112.361 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -66.01 -36.31 82.92 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.964 -1.085 . . . . 0.0 112.862 172.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -59.9 -32.45 70.76 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.99 -50.89 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.824 1.193 . . . . 0.0 111.358 168.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -53.3 -32.92 51.17 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.231 1.412 . . . . 0.0 113.5 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -60.03 -26.02 65.78 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.774 2.43 . . . . 0.0 114.064 173.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.7 t -108.09 -38.14 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 126.326 1.85 . . . . 0.0 111.884 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -127.53 85.21 2.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.481 1.513 . . . . 0.0 110.155 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -53.58 -33.02 53.34 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.518 1.527 . . . . 0.0 113.005 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -117.46 119.02 34.87 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 123.935 0.894 . . . . 0.0 109.426 154.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -75.74 172.01 17.1 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.392 2.728 . . . . 0.0 111.693 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.79 171.37 50.92 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 123.972 0.796 . . . . 0.0 112.221 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.8 mm -64.3 -48.56 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.736 -0.861 . . . . 0.0 110.307 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.58 -28.92 49.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.194 2.198 . . . . 0.0 113.878 173.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.7 mt -80.46 -34.8 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 123.727 0.811 . . . . 0.0 110.605 175.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -67.23 -45.59 76.32 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.868 0.867 . . . . 0.0 111.746 169.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.03 -54.99 36.02 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.093 1.757 . . . . 0.0 112.354 169.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -59.66 -43.59 93.88 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.282 0.946 . . . . 0.0 111.781 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.9 mt -62.41 -42.88 99.77 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 120.964 -1.085 . . . . 0.0 112.728 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.05 -58.63 7.57 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.225 0.921 . . . . 0.0 110.884 173.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -61.39 -32.86 72.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.8 1.24 . . . . 0.0 113.59 -176.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.7 tttp -90.46 -45.02 9.23 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.751 1.221 . . . . 0.0 113.524 -173.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.77 -12.0 60.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.325 1.05 . . . . 0.0 113.061 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 80.99 60.28 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.328 2.651 . . . . 0.0 110.488 171.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.3 mt -136.75 -164.48 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.785 2.834 . . . . 0.0 109.231 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.15 149.05 51.03 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.877 1.271 . . . . 0.0 110.691 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.56 -38.14 66.29 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.71 1.204 . . . . 0.0 113.452 -169.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -55.87 -42.01 75.24 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.598 1.09 . . . . 0.0 112.865 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -67.67 -37.62 82.61 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.114 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.4 mm -72.02 -38.59 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 118.606 0.639 . . . . 0.0 111.854 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.65 -57.5 12.13 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.17 1.388 . . . . 0.0 111.393 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.5 mt -57.38 -41.91 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.751 0.705 . . . . 0.0 110.826 175.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -59.59 -55.22 37.23 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.516 1.053 . . . . 0.0 112.858 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -62.75 -44.83 95.19 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.339 0.972 . . . . 0.0 111.135 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.79 -44.52 86.35 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.424 1.011 . . . . 0.0 111.59 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -60.34 -49.7 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.773 1.169 . . . . 0.0 112.194 173.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -58.07 9.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.136 0.974 . . . . 0.0 112.43 176.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -38.27 87.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.702 1.601 . . . . 0.0 111.867 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.46 -47.07 80.4 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.012 1.278 . . . . 0.0 112.165 171.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -86.57 -11.13 52.42 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -171.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.3 tp -31.61 -62.53 0.19 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 127.196 2.198 . . . . 0.0 113.84 -168.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -62.68 -33.49 75.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.9 51.12 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.135 1.334 . . . . 0.0 112.595 172.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t 48.7 -115.7 0.77 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.75 2.02 . . . . 0.0 112.215 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.572 ' CG ' ' H ' ' A' ' 61' ' ' ARG . 29.1 t60 -152.77 -176.72 5.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.211 1.805 . . . . 0.0 110.694 160.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.572 ' H ' ' CG ' ' A' ' 60' ' ' HIS . 0.1 OUTLIER -68.66 78.88 0.29 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.364 1.065 . . . . 0.0 109.039 153.384 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -136.04 143.8 44.9 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.743 0.782 . . . . 0.0 112.284 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.1 p -151.3 54.1 0.86 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.382 1.473 . . . . 0.0 112.021 -162.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -144.94 76.98 1.51 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.001 1.32 . . . . 0.0 110.546 175.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -150.86 156.77 41.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.78 1.232 . . . . 0.0 111.077 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -83.28 74.74 10.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.099 0.96 . . . . 0.0 111.257 -177.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 45.2 ttp . . . . . 0 C--O 1.248 0.977 0 CA-C-O 116.523 -1.703 . . . . 0.0 111.948 156.407 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.042 0 CA-C-O 119.273 -0.737 . . . . 0.0 111.903 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 119.73 19.45 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.654 1 C-N-CA 133.552 4.741 . . . . 0.0 112.343 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -73.57 158.54 86.23 Favored Pre-proline 0 N--CA 1.479 0.999 0 C-N-CA 125.01 1.324 . . . . 0.0 112.034 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -79.31 47.0 2.36 Favored 'Trans proline' 0 CA--C 1.549 1.243 0 C-N-CA 123.946 3.097 . . . . 0.0 114.893 -173.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.1 ttt85 -142.88 88.4 2.05 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.29 1.836 . . . . 0.0 109.169 165.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.0 m -74.34 -23.19 59.0 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.537 0.735 . . . . 0.0 112.277 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.07 107.37 0.22 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.481 1.512 . . . . 0.0 114.173 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.1 -171.52 0.75 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.306 2.242 . . . . 0.0 113.224 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -66.46 147.05 53.84 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.725 0.81 . . . . 0.0 110.41 158.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -52.09 -34.99 46.47 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.788 0.835 . . . . 0.0 112.717 172.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.13 -11.48 60.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -89.71 -44.69 9.84 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.338 1.855 . . . . 0.0 110.407 166.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.8 mm -54.69 -42.35 60.73 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 C-N-CA 125.4 1.48 . . . . 0.0 110.765 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -50.42 -47.45 56.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 173.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -67.61 -43.07 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.653 1.115 . . . . 0.0 110.081 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.87 -43.38 88.52 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.263 1.025 . . . . 0.0 112.213 -179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.41 ' CD ' HH12 ' A' ' 52' ' ' ARG . 24.2 mt-10 -63.45 -43.36 97.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.724 1.147 . . . . 0.0 113.006 170.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -59.4 -36.5 75.94 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.8 t -71.45 -45.55 68.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 120.227 1.376 . . . . 0.0 111.483 171.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -54.3 -34.34 60.74 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.078 0.951 . . . . 0.0 113.047 176.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -54.02 -39.23 65.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.738 2.015 . . . . 0.0 113.733 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.91 -45.98 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.594 1.558 . . . . 0.0 110.821 174.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -130.17 88.45 2.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.8 1.64 . . . . 0.0 111.498 -168.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.9 m -58.01 -21.49 45.15 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -153.24 88.37 3.77 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.275 1.83 . . . . 0.0 108.58 172.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.96 177.91 8.16 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.52 2.813 . . . . 0.0 112.78 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.07 164.84 54.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.657 0.646 . . . . 0.0 113.744 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 27.3 mm -62.07 -43.38 97.63 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 O-C-N 121.97 -0.724 . . . . 0.0 112.311 -171.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.42 -23.73 64.61 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.389 0.995 . . . . 0.0 113.175 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 22.8 mm -81.71 -40.61 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.674 1.59 . . . . 0.0 110.173 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.67 -49.82 71.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.07 0.948 . . . . 0.0 111.624 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.98 -39.24 85.02 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 169.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.04 -48.46 67.6 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 120.799 1.636 . . . . 0.0 112.702 170.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.2 mt -67.69 -40.08 84.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.83 0.852 . . . . 0.0 112.12 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.63 -55.92 21.66 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.608 1.163 . . . . 0.0 110.992 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -62.9 -51.74 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.753 -0.592 . . . . 0.0 111.954 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -72.43 -8.35 54.58 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.6 mt -120.87 4.63 10.49 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.026 1.33 . . . . 0.0 112.382 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.8 t30 37.23 75.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.425 2.69 . . . . 0.0 112.684 -165.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.5 mt -135.89 164.78 27.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.039 2.536 . . . . 0.0 107.79 169.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -87.91 155.24 19.95 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 120.704 -1.248 . . . . 0.0 112.184 166.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -45.01 -49.91 11.03 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.38 1.872 . . . . 0.0 111.646 175.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.08 -39.13 77.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.643 1.177 . . . . 0.0 113.839 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.95 -43.22 79.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.749 -1.22 . . . . 0.0 111.141 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.5 mm -66.14 -42.01 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.621 0.646 . . . . 0.0 111.026 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -56.5 -52.09 66.05 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.318 0.963 . . . . 0.0 112.123 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -59.25 -37.68 70.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.25 -0.906 . . . . 0.0 111.58 173.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -60.66 -59.93 4.6 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 120.514 1.506 . . . . 0.0 112.267 171.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -55.17 -47.42 75.19 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.975 0.51 . . . . 0.0 111.59 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -62.66 -39.45 93.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 116.831 -1.557 . . . . 0.0 112.856 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -60.65 -40.04 90.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 121.427 1.921 . . . . 0.0 111.443 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.41 HH12 ' CD ' ' A' ' 17' ' ' GLU . 12.4 mmt85 -66.22 -55.46 16.08 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER -69.04 -18.4 64.01 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 177.809 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.12 -60.66 2.2 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.745 1.157 . . . . 0.0 111.368 162.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -53.76 -41.93 67.69 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.309 0.958 . . . . 0.0 112.536 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 67.1 tp -39.82 -48.23 2.23 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.678 1.991 . . . . 0.0 112.996 175.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -133.18 60.95 1.69 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.843 1.257 . . . . 0.0 109.79 171.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.2 ttm-85 -63.8 142.91 58.23 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.884 -0.51 . . . . 0.0 110.62 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.0 t -62.81 130.9 46.92 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 161.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -81.34 41.29 0.6 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.349 1.46 . . . . 0.0 111.674 -175.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -85.02 173.36 10.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.986 2.514 . . . . 0.0 114.943 -164.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -108.11 163.63 12.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.302 1.841 . . . . 0.0 112.127 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.9 t -144.4 172.01 13.54 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.064 1.346 . . . . 0.0 109.759 154.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -114.41 123.71 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.542 1.537 . . . . 0.0 110.177 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -156.81 156.1 32.67 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.758 1.623 . . . . 0.0 109.228 173.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.407 ' CD1' ' H ' ' A' ' 67' ' ' MET . 0.2 OUTLIER -141.06 174.24 10.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.303 1.441 . . . . 0.0 111.588 178.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.407 ' H ' ' CD1' ' A' ' 66' ' ' LEU . 27.9 ttt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 126.591 1.956 . . . . 0.0 108.837 164.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.681 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -75.5 93.07 2.94 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.56 -0.965 . . . . 0.0 113.061 -163.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -134.04 88.12 32.58 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 124.585 1.154 . . . . 0.0 113.165 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -61.35 155.25 53.12 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 121.861 1.707 . . . . 0.0 110.912 169.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.81 55.47 0.56 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 127.362 2.265 . . . . 0.0 113.537 -166.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.3 m -59.76 138.8 57.67 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.454 -0.779 . . . . 0.0 110.749 170.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.33 174.33 10.51 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.91 1.684 . . . . 0.0 110.003 167.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -136.34 -173.06 3.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.934 2.093 . . . . 0.0 110.601 -169.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.6 t -57.07 145.96 29.03 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.634 -0.667 . . . . 0.0 111.042 162.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -58.81 -24.08 61.36 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.38 -41.16 96.66 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.372 0.987 . . . . 0.0 113.398 169.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -79.92 -30.68 40.08 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.156 0.982 . . . . 0.0 111.816 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mm -62.36 -49.14 85.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.478 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.281 168.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.26 -31.06 71.58 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.296 1.407 . . . . 0.0 114.213 -176.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 75.4 t -66.12 -46.82 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.018 0.826 . . . . 0.0 110.758 170.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.4 -43.08 86.78 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.305 1.042 . . . . 0.0 112.654 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -52.99 -52.57 57.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.846 1.658 . . . . 0.0 112.135 164.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -54.43 -46.42 73.23 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.899 0.772 . . . . 0.0 112.405 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 75.7 t -58.77 -52.02 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.362 172.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -56.23 -41.36 75.56 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.681 1.582 . . . . 0.0 112.177 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -61.73 -25.47 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.119 1.767 . . . . 0.0 113.521 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.6 t -100.65 -28.33 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.942 1.697 . . . . 0.0 112.284 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -140.96 83.6 1.89 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.59 2.356 . . . . 0.0 111.147 -171.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.5 m -57.42 -25.19 59.21 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -135.24 96.81 13.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.642 1.577 . . . . 0.0 109.944 166.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.92 163.61 38.29 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.472 2.115 . . . . 0.0 111.447 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.87 169.26 50.15 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.064 0.84 . . . . 0.0 113.176 172.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 mm -61.77 -38.64 80.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.695 -0.885 . . . . 0.0 111.937 -176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -30.19 69.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.955 1.302 . . . . 0.0 112.252 177.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.0 mt -71.65 -41.31 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 119.3 0.955 . . . . 0.0 110.038 170.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.02 -46.66 88.76 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.667 -0.646 . . . . 0.0 111.845 172.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -63.21 -37.9 89.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.686 1.595 . . . . 0.0 114.294 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -68.41 -38.81 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.016 -1.052 . . . . 0.0 111.924 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.14 -45.96 86.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.445 0.698 . . . . 0.0 111.329 170.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.87 -60.14 3.52 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.867 1.267 . . . . 0.0 111.388 174.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.4 tp60 -63.21 -27.02 69.07 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -107.48 -4.62 18.27 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -108.54 -6.53 16.05 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.77 2.028 . . . . 0.0 112.13 165.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.75 60.96 3.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.665 1.586 . . . . 0.0 111.388 -170.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.4 mt -131.53 155.24 47.79 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 127.372 2.269 . . . . 0.0 109.197 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.548 ' CD ' ' HE ' ' A' ' 44' ' ' ARG . 4.8 pm0 -76.36 142.89 41.04 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 122.784 1.278 . . . . 0.0 111.066 160.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.7 tt -50.58 -35.71 31.36 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 124.958 1.303 . . . . 0.0 111.594 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.33 -51.29 46.75 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.253 1.821 . . . . 0.0 113.229 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.548 ' HE ' ' CD ' ' A' ' 41' ' ' GLU . 85.9 mtt-85 -63.67 -41.55 98.16 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.559 -0.713 . . . . 0.0 111.395 176.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 48.5 mt -70.38 -37.2 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -61.35 -51.52 68.5 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.014 1.326 . . . . 0.0 110.533 172.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.4 mt -57.78 -42.49 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 118.079 -0.962 . . . . 0.0 110.404 173.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -58.1 -62.4 1.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.285 1.402 . . . . 0.0 112.277 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -55.6 -45.28 77.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.229 0.922 . . . . 0.0 112.519 -177.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -63.92 -38.61 91.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.534 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -60.96 -46.41 90.81 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.397 1.453 . . . . 0.0 112.502 170.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.94 -50.72 72.28 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.392 0.996 . . . . 0.0 111.866 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -57.02 -43.69 82.1 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.054 0.941 . . . . 0.0 112.166 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.07 85.97 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 119.102 0.864 . . . . 0.0 113.071 173.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -59.34 -44.38 92.66 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.736 0.815 . . . . 0.0 112.163 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.17 12.36 0.12 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.298 1.839 . . . . 0.0 115.216 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -128.93 -47.87 1.23 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.462 1.905 . . . . 0.0 110.961 169.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.23 154.57 7.82 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.434 -0.791 . . . . 0.0 111.602 177.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.2 t 67.44 17.39 10.08 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -51.61 -29.46 17.59 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 120.026 1.285 . . . . 0.0 114.036 169.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 66.83 8.82 6.3 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 127.941 2.496 . . . . 0.0 116.89 164.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -55.96 138.65 48.45 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.993 0.917 . . . . 0.0 111.965 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.7 m -75.78 55.43 0.87 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.247 1.419 . . . . 0.0 114.137 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -140.22 119.97 13.39 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.672 1.589 . . . . 0.0 109.343 172.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -152.37 87.64 1.33 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.439 0.696 . . . . 0.0 111.298 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.54 156.14 49.17 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.592 1.557 . . . . 0.0 109.974 171.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.467 1.907 . . . . 0.0 111.041 -179.063 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.238 0 CA-C-O 118.704 -1.053 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -129.05 163.83 24.56 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 118.747 1.274 . . . . 0.0 112.106 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 18.18 72.07 0.21 Allowed Pre-proline 0 N--CA 1.486 1.343 0 C-N-CA 128.874 2.87 . . . . 0.0 115.688 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.46 44.89 1.32 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 124.637 3.558 . . . . 0.0 112.71 175.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -156.47 142.38 17.96 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 127.222 2.209 . . . . 0.0 109.452 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.8 m -143.44 108.88 5.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.887 0.375 . . . . 0.0 109.99 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.7 161.03 15.8 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.956 0.902 . . . . 0.0 110.55 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -129.7 -165.11 1.48 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.201 1.8 . . . . 0.0 111.095 -166.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.33 144.42 53.99 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.962 -0.461 . . . . 0.0 109.792 156.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.32 -28.45 67.99 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.362 -1.461 . . . . 0.0 113.395 -174.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -68.84 -1.81 8.07 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.93 1.455 . . . . 0.0 114.93 170.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -104.82 -38.74 6.55 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.129 1.772 . . . . 0.0 111.031 166.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mm -55.43 -53.06 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.585 0.754 . . . . 0.0 111.352 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.92 -26.82 68.47 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -176.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.8 t -66.0 -51.44 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 120.405 1.457 . . . . 0.0 109.849 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -59.0 -47.12 86.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.608 0.763 . . . . 0.0 111.504 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.09 -30.32 66.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 117.183 -1.389 . . . . 0.0 114.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -66.28 -17.21 64.61 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 121.072 1.76 . . . . 0.0 112.948 166.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.62 -52.0 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 120.266 1.394 . . . . 0.0 111.859 161.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -55.47 -31.34 61.9 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.035 . . . . 0.0 113.722 178.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -53.27 -11.94 0.35 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 131.488 3.915 . . . . 0.0 115.423 168.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 44.2 t -132.77 -54.59 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 127.3 2.24 . . . . 0.0 110.703 175.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -100.87 92.0 4.85 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.731 1.613 . . . . 0.0 111.582 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.6 m -55.2 -32.35 62.15 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 176.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -144.69 97.33 5.01 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.386 1.875 . . . . 0.0 108.682 170.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -79.37 179.85 6.02 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.371 2.714 . . . . 0.0 113.116 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.21 162.16 54.46 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.253 0.93 . . . . 0.0 113.202 169.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 mm -68.04 -29.86 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 O-C-N 121.837 -0.802 . . . . 0.0 111.311 -178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.98 -33.47 75.81 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.373 1.869 . . . . 0.0 113.335 171.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.6 mm -71.42 -41.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 119.021 0.828 . . . . 0.0 110.434 170.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.44 -41.57 96.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.864 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.26 -50.41 74.09 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.876 2.07 . . . . 0.0 113.172 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -58.45 -41.02 84.19 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.595 1.089 . . . . 0.0 112.523 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.16 -48.64 72.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.053 0.941 . . . . 0.0 112.077 170.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -48.14 69.86 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.282 1.033 . . . . 0.0 111.864 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -55.88 -60.08 3.97 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.374 1.07 . . . . 0.0 112.394 171.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -65.43 -2.39 3.22 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.2 mt -128.26 -6.33 5.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.275 1.43 . . . . 0.0 113.701 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 43.45 73.15 0.15 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.067 1.347 . . . . 0.0 110.928 -158.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.45 -173.89 3.48 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.344 1.857 . . . . 0.0 109.199 171.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -137.2 150.13 47.68 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 125.273 1.429 . . . . 0.0 110.347 -177.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.2 tp -42.39 -54.34 3.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.796 1.239 . . . . 0.0 114.328 -171.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.07 -30.24 70.86 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.55 1.068 . . . . 0.0 113.684 -178.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -71.92 -37.5 70.04 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.962 1.255 . . . . 0.0 110.643 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -46.82 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.891 0.769 . . . . 0.0 111.454 171.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -54.37 -50.48 67.4 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.482 1.037 . . . . 0.0 112.135 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -62.3 -38.9 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 120.649 -1.282 . . . . 0.0 111.511 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -57.41 -57.34 13.08 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 120.324 1.42 . . . . 0.0 111.971 170.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -56.9 -48.58 77.89 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.286 1.034 . . . . 0.0 111.553 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -61.52 -41.29 97.1 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.07 0.948 . . . . 0.0 111.909 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.87 -41.53 95.6 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 120.512 1.506 . . . . 0.0 111.951 174.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -59.99 4.07 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.47 1.108 . . . . 0.0 112.079 172.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -54.08 -49.19 69.64 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.342 1.457 . . . . 0.0 111.45 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.36 74.19 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.906 0.775 . . . . 0.0 112.895 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -73.14 -32.99 65.25 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.4 mp -64.64 -52.73 55.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.871 0.76 . . . . 0.0 110.753 167.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.13 -50.15 73.7 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.052 1.341 . . . . 0.0 111.691 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -90.73 62.7 5.16 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.903 -1.123 . . . . 0.0 111.35 165.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -58.54 -53.14 61.74 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.489 0.316 . . . . 0.0 110.716 168.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -136.65 -152.76 0.46 Allowed 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.307 2.243 . . . . 0.0 109.867 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -115.72 142.93 46.09 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.883 1.273 . . . . 0.0 110.135 167.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -149.16 177.57 9.5 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.307 1.043 . . . . 0.0 110.811 166.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 t 50.35 38.07 16.95 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.469 1.508 . . . . 0.0 114.78 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -151.6 140.65 21.15 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.18 0.992 . . . . 0.0 110.391 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -118.21 167.38 11.56 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.556 1.142 . . . . 0.0 110.142 168.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.0 tp -154.0 127.03 8.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.772 1.229 . . . . 0.0 110.109 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.982 0 C-N-CA 125.637 1.575 . . . . 0.0 109.23 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.173 0 N-CA-C 108.59 -1.804 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -68.07 -19.83 64.91 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.065 1.432 . . . . 0.0 113.394 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -78.81 152.59 77.57 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.695 1.198 . . . . 0.0 112.293 168.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -75.9 56.51 4.79 Favored 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 125.03 3.82 . . . . 0.0 111.954 173.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.59 23.0 4.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.274 1.829 . . . . 0.0 114.05 -168.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 96.7 m -70.8 119.47 14.98 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.567 1.547 . . . . 0.0 112.034 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.51 172.34 7.4 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.687 1.195 . . . . 0.0 112.527 168.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -125.29 -166.59 1.56 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.939 2.096 . . . . 0.0 111.786 -171.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -76.59 152.71 35.83 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.074 0.95 . . . . 0.0 109.982 158.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -59.81 -38.71 82.72 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.435 -1.415 . . . . 0.0 113.044 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.83 -10.35 56.34 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -90.04 -47.43 7.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.771 1.628 . . . . 0.0 110.9 163.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.437 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 22.1 mm -50.94 -47.75 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.367 1.067 . . . . 0.0 111.972 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -61.02 -23.59 65.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.1 t -68.7 -50.76 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 120.063 1.301 . . . . 0.0 110.114 169.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.8 mp -62.13 -43.68 98.3 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 176.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.72 -42.45 79.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.778 -1.201 . . . . 0.0 113.651 169.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.5 -23.71 67.09 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 173.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.4 t -77.3 -47.0 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 119.91 1.232 . . . . 0.0 111.155 165.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -61.92 -30.96 71.24 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.85 1.66 . . . . 0.0 114.225 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -59.59 -17.99 37.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.076 1.307 . . . . 0.0 113.993 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.8 t -113.22 -37.64 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 126.556 1.943 . . . . 0.0 112.076 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -111.61 91.46 3.67 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.095 1.358 . . . . 0.0 112.274 -170.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -57.18 -30.5 64.56 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.472 -0.767 . . . . 0.0 112.868 167.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -139.46 114.83 8.18 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 127.854 2.462 . . . . 0.0 108.792 158.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -76.99 179.11 6.84 Favored 'Trans proline' 0 CA--C 1.55 1.31 0 C-N-CA 122.553 2.169 . . . . 0.0 110.724 167.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.71 166.02 39.07 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.442 -0.786 . . . . 0.0 113.196 170.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.2 mm -66.46 -36.89 78.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.848 -177.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.95 -26.56 68.27 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.608 1.549 . . . . 0.0 112.643 173.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.4 mm -74.55 -37.22 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.047 -1.033 . . . . 0.0 111.055 170.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 38.1 mt -67.5 -42.19 83.25 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.481 -0.762 . . . . 0.0 112.107 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.45 -49.02 77.59 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.788 1.635 . . . . 0.0 113.055 167.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -60.1 -43.41 95.59 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.458 1.026 . . . . 0.0 112.14 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.0 -45.89 93.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.883 0.873 . . . . 0.0 112.075 171.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.36 -51.56 67.86 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.228 1.011 . . . . 0.0 111.519 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -52.94 -63.51 1.12 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.944 1.297 . . . . 0.0 112.418 170.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -69.72 -13.67 62.41 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -171.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.75 1.76 13.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.465 1.106 . . . . 0.0 112.978 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 39.09 68.29 0.37 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.53 2.332 . . . . 0.0 112.856 -162.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.7 mt -120.45 -166.68 1.35 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.385 2.274 . . . . 0.0 109.036 171.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -134.19 159.19 41.66 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.812 -1.18 . . . . 0.0 110.504 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -44.69 -55.27 5.41 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.287 1.835 . . . . 0.0 112.2 -175.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -66.06 -27.37 68.04 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -65.88 -37.7 86.82 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 121.548 1.976 . . . . 0.0 110.766 171.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -41.71 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 118.342 0.519 . . . . 0.0 111.404 174.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -57.99 -52.99 63.22 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.099 0.863 . . . . 0.0 111.747 173.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.71 -36.14 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.96 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.437 ' HE1' ' CD1' ' A' ' 13' ' ' ILE . 71.2 t90 -61.89 -60.17 4.04 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.378 1.444 . . . . 0.0 112.218 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -59.74 -43.26 94.32 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.464 0.575 . . . . 0.0 111.385 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -49.03 79.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.918 175.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -59.16 -39.67 83.21 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.858 1.663 . . . . 0.0 111.461 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -62.98 1.43 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.194 0.998 . . . . 0.0 112.694 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.27 5.1 ptm180 -63.18 -35.36 80.05 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.992 1.269 . . . . 0.0 112.985 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.77 -18.49 65.37 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -131.69 17.97 4.74 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.766 1.226 . . . . 0.0 113.419 -173.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -43.18 -57.13 3.09 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.573 1.949 . . . . 0.0 113.665 -172.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.61 -16.72 64.39 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -76.37 34.84 0.14 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 0.0 113.715 169.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -63.16 168.93 3.81 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.894 -1.128 . . . . 0.0 111.906 171.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -66.85 -52.71 40.39 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.014 -1.054 . . . . 0.0 110.125 161.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.6 tpp85 -137.7 134.57 35.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.108 2.563 . . . . 0.0 108.61 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -81.88 123.43 28.82 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.015 0.825 . . . . 0.0 111.073 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.0 m -68.19 88.67 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.918 1.287 . . . . 0.0 113.353 -177.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -133.06 143.9 49.66 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.295 1.438 . . . . 0.0 109.525 162.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -153.99 179.72 8.65 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.385 0.674 . . . . 0.0 112.379 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 24.1 tp -125.59 169.3 12.62 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.54 1.936 . . . . 0.0 111.505 -172.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.2 ttp . . . . . 0 C--O 1.25 1.114 0 C-N-CA 125.175 1.39 . . . . 0.0 111.471 163.83 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.975 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -61.59 118.33 6.91 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.033 -175.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 53.68 123.71 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 131.342 3.857 . . . . 0.0 114.313 -164.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.46 65.96 7.28 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.696 2.93 . . . . 0.0 112.575 -176.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -125.76 58.22 1.33 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.406 1.882 . . . . 0.0 110.264 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -74.68 81.56 2.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.711 1.204 . . . . 0.0 112.661 -173.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -78.89 164.13 24.71 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.038 0.535 . . . . 0.0 111.202 160.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.416 ' H ' HD13 ' A' ' 13' ' ' ILE . 30.3 m-85 -129.46 -172.27 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.174 2.19 . . . . 0.0 110.422 172.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.3 t -70.86 148.7 47.53 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.026 -0.421 . . . . 0.0 110.468 164.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -49.62 -41.9 43.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.615 1.966 . . . . 0.0 113.874 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -16.59 61.48 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 120.33 1.423 . . . . 0.0 113.838 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -84.12 -40.68 17.94 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.496 1.119 . . . . 0.0 110.32 167.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.416 HD13 ' H ' ' A' ' 8' ' ' PHE . 26.5 mm -54.0 -51.59 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.104 0.962 . . . . 0.0 111.586 171.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.0 -37.24 66.34 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 85.3 t -66.67 -47.63 82.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.334 1.425 . . . . 0.0 110.857 174.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.76 -43.87 95.15 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.572 1.149 . . . . 0.0 112.22 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -49.87 -55.52 14.01 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.652 1.581 . . . . 0.0 111.087 164.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 -58.27 -12.94 4.15 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.899 1.815 . . . . 0.0 115.899 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 98.9 t -86.76 -49.62 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 120.714 1.597 . . . . 0.0 111.701 161.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -54.09 -30.53 48.83 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.342 1.057 . . . . 0.0 113.78 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -53.63 -28.13 31.11 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.783 1.233 . . . . 0.0 114.038 175.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.1 t -110.2 -48.92 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.876 2.07 . . . . 0.0 111.451 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -110.62 82.83 1.66 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.798 1.239 . . . . 0.0 111.667 -175.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.3 m -54.4 -33.88 60.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.272 -0.893 . . . . 0.0 112.501 169.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -124.9 103.03 31.05 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 126.757 2.023 . . . . 0.0 108.971 167.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -81.18 176.37 8.87 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.859 3.039 . . . . 0.0 112.739 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.94 163.45 31.92 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.519 1.057 . . . . 0.0 112.876 169.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.9 mm -59.43 -38.11 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.019 1.328 . . . . 0.0 111.127 -177.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.52 -27.57 61.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.759 2.024 . . . . 0.0 112.325 -177.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 57.5 mt -76.45 -39.85 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 170.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.5 mt -62.06 -46.18 90.25 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.682 0.793 . . . . 0.0 111.344 172.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.85 -49.93 75.02 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 165.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.47 -30.35 66.91 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.22 1.827 . . . . 0.0 114.614 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -70.57 -49.76 44.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.842 0.857 . . . . 0.0 112.263 167.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.37 64.07 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.671 1.189 . . . . 0.0 112.324 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.73 -12.36 46.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.595 2.758 . . . . 0.0 114.012 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -118.74 -34.89 3.83 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.849 1.26 . . . . 0.0 113.873 -176.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.9 mt -85.95 -13.36 47.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.96 0.904 . . . . 0.0 113.058 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 67.97 65.84 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.285 2.234 . . . . 0.0 111.856 -169.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.9 mt -139.36 177.93 7.56 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.221 2.208 . . . . 0.0 109.699 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -115.46 158.85 21.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.83 1.252 . . . . 0.0 112.002 165.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.19 -41.27 68.38 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.492 1.117 . . . . 0.0 113.796 -169.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -33.74 73.66 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.478 1.035 . . . . 0.0 113.257 176.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -68.69 -39.25 80.64 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.628 -1.295 . . . . 0.0 110.546 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.61 -47.72 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.04 171.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -54.65 -49.98 69.29 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.751 1.159 . . . . 0.0 111.912 175.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.5 mt -62.5 -38.04 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 117.558 -1.211 . . . . 0.0 111.222 174.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -58.44 -58.21 9.54 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 121.029 1.74 . . . . 0.0 111.542 170.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -54.1 -51.39 64.33 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 118.91 0.777 . . . . 0.0 112.743 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.54 -40.59 83.41 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 118.21 -0.9 . . . . 0.0 112.275 174.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -62.35 -46.66 87.67 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 120.771 1.623 . . . . 0.0 112.896 174.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -61.57 -46.79 88.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 120.151 1.341 . . . . 0.0 111.529 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -47.3 85.69 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.801 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.72 -54.13 49.9 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.54 1.136 . . . . 0.0 111.623 173.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -56.45 -38.03 71.09 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.533 1.133 . . . . 0.0 112.692 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.38 -45.95 65.01 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.315 1.046 . . . . 0.0 112.179 176.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -63.62 -28.68 70.09 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.942 0.897 . . . . 0.0 112.129 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.262 5.8 ttt180 46.75 -44.91 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.295 1 C-N-CA 134.914 5.286 . . . . 0.0 117.9 177.621 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.0 t 54.23 27.12 7.45 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.647 1.979 . . . . 0.0 115.477 168.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.91 172.03 10.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.654 1.182 . . . . 0.0 112.747 -175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -126.01 126.65 44.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.829 1.252 . . . . 0.0 110.65 163.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 50.9 -175.93 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.097 2.159 . . . . 0.0 113.894 -169.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.2 t -169.41 169.66 8.83 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.435 1.894 . . . . 0.0 109.649 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.11 144.26 36.67 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.798 1.239 . . . . 0.0 109.888 159.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -152.13 178.75 9.14 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.266 0.555 . . . . 0.0 112.373 -175.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 tp -119.61 -172.8 2.4 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.017 1.727 . . . . 0.0 111.316 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.253 1.421 . . . . 0.0 110.322 169.304 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.759 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -97.85 160.75 14.11 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.98 1.712 . . . . 0.0 112.613 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 80.13 124.44 0.03 OUTLIER Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 130.18 3.392 . . . . 0.0 113.56 175.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -76.06 68.59 6.55 Favored 'Trans proline' 0 CA--C 1.548 1.21 0 C-N-CA 122.977 2.451 . . . . 0.0 112.148 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 50.22 1.84 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.236 1.415 . . . . 0.0 112.385 176.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -59.73 123.53 17.25 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.948 1.699 . . . . 0.0 113.272 179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -128.18 171.22 12.14 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.118 1.767 . . . . 0.0 110.816 161.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -137.76 -176.66 4.5 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.321 1.848 . . . . 0.0 111.961 -175.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.2 t -66.81 147.07 53.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.265 0.626 . . . . 0.0 110.784 166.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -55.17 -35.37 64.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.42 1.088 . . . . 0.0 113.218 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -5.53 32.34 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 125.266 1.427 . . . . 0.0 114.707 175.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -109.15 -33.3 6.92 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.49 1.916 . . . . 0.0 111.143 167.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -55.27 -51.96 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.28 1.032 . . . . 0.0 111.343 167.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -57.2 -34.42 68.5 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.7 t -69.1 -39.34 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 119.952 1.251 . . . . 0.0 110.173 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.6 mt -69.13 -46.99 66.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.376 1.07 . . . . 0.0 111.495 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -58.19 -39.22 78.37 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.093 0.86 . . . . 0.0 112.523 170.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -61.91 -27.97 69.2 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.843 -1.161 . . . . 0.0 114.121 172.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.2 t -76.5 -50.77 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 119.975 1.261 . . . . 0.0 111.098 166.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.57 -34.48 71.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.571 1.148 . . . . 0.0 113.62 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -65.25 -17.81 64.8 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 174.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.9 t -98.48 -45.81 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.759 1.623 . . . . 0.0 110.77 174.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -133.25 108.03 8.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.456 1.102 . . . . 0.0 112.952 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.5 t -51.3 -39.86 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.043 1.737 . . . . 0.0 113.002 169.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.38 92.52 20.55 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 126.278 1.831 . . . . 0.0 110.533 175.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.26 176.46 10.07 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 123.185 2.59 . . . . 0.0 112.636 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.96 170.52 45.57 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.679 1.133 . . . . 0.0 114.647 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 21.8 mm -66.44 -34.89 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.716 -0.873 . . . . 0.0 111.769 -175.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.16 -29.88 70.06 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.171 1.389 . . . . 0.0 112.574 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mm -76.22 -40.82 36.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.118 0.967 . . . . 0.0 109.698 174.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.47 -47.74 82.67 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.723 -0.61 . . . . 0.0 112.06 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.72 -55.92 26.56 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.963 1.305 . . . . 0.0 112.401 168.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -62.8 -22.23 66.48 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.24 -1.538 . . . . 0.0 114.013 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -76.42 -50.04 15.17 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.016 -1.052 . . . . 0.0 112.138 164.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.4 -53.28 47.05 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.374 1.47 . . . . 0.0 111.921 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -64.17 -12.7 42.65 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.221 1.408 . . . . 0.0 114.15 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -123.23 -47.05 2.03 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.745 1.157 . . . . 0.0 114.002 -164.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.58 -17.06 61.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.526 1.13 . . . . 0.0 112.922 168.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 71.2 74.12 0.18 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.667 2.787 . . . . 0.0 111.191 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -142.3 175.44 9.76 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.367 1.867 . . . . 0.0 109.654 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -99.27 148.96 23.6 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 121.658 -0.652 . . . . 0.0 110.324 162.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 tt -42.83 -48.13 5.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.184 1.393 . . . . 0.0 112.937 175.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.09 -41.3 87.74 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -65.16 -34.87 79.41 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.595 -1.316 . . . . 0.0 111.646 175.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.0 mt -74.6 -42.51 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 118.703 -0.665 . . . . 0.0 112.177 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -52.49 -52.65 53.35 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.249 1.42 . . . . 0.0 111.882 170.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.82 -43.66 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 123.895 0.878 . . . . 0.0 110.693 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 84.4 t90 -55.87 -53.07 61.27 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.99 1.268 . . . . 0.0 112.496 172.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -59.03 -47.48 85.07 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 118.704 0.684 . . . . 0.0 111.671 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -47.22 83.84 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.288 0.949 . . . . 0.0 111.573 176.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -63.03 -39.4 94.64 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.986 1.266 . . . . 0.0 112.515 177.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.98 -54.63 42.51 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.74 -1.225 . . . . 0.0 112.547 168.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -28.75 67.17 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.276 1.43 . . . . 0.0 113.718 -175.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.35 -32.11 64.35 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 167.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -69.53 -57.95 4.57 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 117.469 -1.253 . . . . 0.0 112.825 172.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp 30.33 59.39 0.21 Allowed 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 126.079 1.752 . . . . 0.0 112.711 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.258 42.7 pttt 50.43 5.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 120.203 3.409 . . . . 0.0 120.203 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 12.09 -78.45 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 128.066 2.546 . . . . 0.0 117.347 -166.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.5 m -114.77 17.74 16.92 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.523 1.929 . . . . 0.0 114.048 -168.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -125.95 161.41 27.55 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.24 -1.538 . . . . 0.0 113.619 -176.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmp_? -61.56 -56.0 24.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.665 1.586 . . . . 0.0 112.687 173.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 52.23 16.16 0.54 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.851 2.06 . . . . 0.0 115.64 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 p -69.15 98.2 0.98 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.464 1.506 . . . . 0.0 112.728 176.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.1 123.43 14.79 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.325 1.85 . . . . 0.0 108.218 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -150.73 141.56 22.83 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.932 1.293 . . . . 0.0 111.238 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -156.8 -62.3 0.1 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.904 1.282 . . . . 0.0 112.939 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 C--O 1.252 1.222 0 C-N-CA 129.144 2.978 . . . . 0.0 111.042 -174.906 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.167 0 CA-C-O 118.479 -1.178 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -61.69 59.7 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 129.062 2.945 . . . . 0.0 117.082 -175.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -134.94 167.77 21.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 127.802 2.441 . . . . 0.0 110.993 170.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -78.9 171.67 16.16 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.824 2.35 . . . . 0.0 113.034 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.57 123.21 42.61 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.571 1.548 . . . . 0.0 108.237 166.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 52.4 m 64.1 -80.77 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.35 1.46 . . . . 0.0 114.594 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 50.81 170.07 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 126.497 1.919 . . . . 0.0 115.458 -161.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -135.93 -174.04 3.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.575 1.95 . . . . 0.0 111.301 -168.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -75.79 152.5 37.32 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.515 -0.741 . . . . 0.0 110.434 164.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.09 -25.96 64.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -72.06 -3.07 20.87 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.981 1.719 . . . . 0.0 114.573 171.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -110.08 -33.41 6.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.635 1.974 . . . . 0.0 111.405 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mm -63.04 -44.53 99.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.595 0 CA-C-O 117.649 -1.167 . . . . 0.0 111.44 170.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -54.63 -43.89 72.67 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.69 1.586 . . . . 0.0 113.763 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 39.4 t -66.87 -39.98 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.091 0.859 . . . . 0.0 110.47 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.21 -46.35 64.71 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.461 1.105 . . . . 0.0 112.403 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -64.31 -36.13 83.12 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.775 -1.203 . . . . 0.0 112.609 171.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -59.34 -46.34 88.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.659 1.118 . . . . 0.0 112.601 169.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 87.8 t -64.76 -43.25 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 121.256 -0.903 . . . . 0.0 111.241 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -54.86 -43.0 72.72 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.704 1.138 . . . . 0.0 112.63 174.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -63.9 -13.1 42.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.362 2.265 . . . . 0.0 114.525 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.35 -41.96 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.955 1.702 . . . . 0.0 111.476 169.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -143.87 104.13 4.13 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.414 2.286 . . . . 0.0 110.234 -174.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 72.0 m -57.49 -22.26 42.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -158.78 82.47 2.62 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.702 2.001 . . . . 0.0 110.181 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.41 177.9 8.04 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.335 2.69 . . . . 0.0 111.956 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.43 167.31 54.81 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 121.785 -0.572 . . . . 0.0 114.337 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.1 mm -58.3 -47.34 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.802 0 C-N-CA 124.148 0.979 . . . . 0.0 111.667 -173.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -62.59 -26.13 68.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.132 0.973 . . . . 0.0 112.767 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.3 mm -74.47 -44.86 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.654 1.182 . . . . 0.0 110.285 172.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.3 mt -63.27 -39.77 95.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.878 0.871 . . . . 0.0 111.544 173.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -74.01 -33.82 63.94 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.181 1.393 . . . . 0.0 114.458 175.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.73 -41.8 91.72 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.932 1.696 . . . . 0.0 112.158 166.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -61.78 -51.29 68.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.321 0.648 . . . . 0.0 111.402 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.74 -44.06 66.17 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.209 1.004 . . . . 0.0 112.533 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -20.48 27.95 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.644 1.977 . . . . 0.0 114.864 177.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -118.31 -36.98 3.42 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.919 1.236 . . . . 0.0 113.53 -176.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.7 mt -73.61 -9.55 58.79 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.1 1.36 . . . . 0.0 113.456 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 48.26 77.29 0.1 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.509 2.324 . . . . 0.0 112.425 -165.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.86 -179.46 5.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.085 2.554 . . . . 0.0 108.35 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -112.59 159.59 18.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.693 1.597 . . . . 0.0 111.623 164.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.63 -46.67 40.18 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.077 1.351 . . . . 0.0 111.981 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -54.95 -53.42 55.85 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.81 1.244 . . . . 0.0 113.653 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -68.0 -31.8 71.75 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.092 0.86 . . . . 0.0 111.923 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -42.28 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.378 0.99 . . . . 0.0 111.029 169.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -57.74 -54.22 49.36 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.844 1.258 . . . . 0.0 112.019 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.53 -35.69 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.199 -0.938 . . . . 0.0 111.222 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -59.46 -56.45 21.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.724 1.602 . . . . 0.0 112.369 170.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.66 -43.23 94.0 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.858 0.863 . . . . 0.0 111.991 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -55.85 -47.63 76.94 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.854 1.262 . . . . 0.0 110.284 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -74.84 3.3 8.37 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 174.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.41 -64.27 1.17 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 109.921 152.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -45.3 72.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.722 1.209 . . . . 0.0 112.951 -172.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.9 -5.31 29.74 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -134.31 15.5 3.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.898 1.279 . . . . 0.0 113.499 -178.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.4 tt -43.14 -52.2 5.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.402 1.881 . . . . 0.0 113.812 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -62.72 -32.84 74.02 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 62.94 149.49 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.468 2.307 . . . . 0.0 115.172 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.0 m -68.23 35.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 128.47 2.708 . . . . 0.0 114.66 167.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -144.71 88.26 1.9 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.196 1.398 . . . . 0.0 110.375 -172.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 77.36 135.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 127.943 2.497 . . . . 0.0 113.269 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 62' ' ' GLU . 20.5 mp0 -61.71 98.49 0.09 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.744 2.418 . . . . 0.0 110.571 -174.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 m -126.89 92.91 3.63 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.205 -0.934 . . . . 0.0 112.511 -165.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -66.83 132.26 47.65 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.644 0.778 . . . . 0.0 112.965 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -150.43 147.59 27.73 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.423 2.689 . . . . 0.0 108.125 168.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 97.5 mt -132.36 168.69 17.68 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.357 1.463 . . . . 0.0 110.323 173.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 25.1 ptp . . . . . 0 C--O 1.248 1.014 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.307 174.276 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.165 0 CA-C-O 118.912 -0.938 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -57.95 100.14 0.05 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.07 1.748 . . . . 0.0 112.733 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -149.36 165.69 17.05 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 128.256 2.622 . . . . 0.0 111.317 -179.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -75.45 -175.96 2.7 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 124.944 3.763 . . . . 0.0 114.551 -177.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? 47.17 59.95 3.73 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 128.242 2.617 . . . . 0.0 113.715 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.1 m -64.81 134.17 53.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.833 1.653 . . . . 0.0 112.609 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -136.76 164.56 27.99 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.999 1.32 . . . . 0.0 111.128 165.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -128.15 179.91 5.34 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.337 1.855 . . . . 0.0 112.229 -171.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.9 t -59.34 146.52 39.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 0.0 111.078 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -55.67 -36.82 67.5 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.495 -0.753 . . . . 0.0 112.981 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -16.31 45.0 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.466 1.107 . . . . 0.0 113.192 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -99.09 -46.45 5.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.006 1.722 . . . . 0.0 111.132 170.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 mm -47.85 -49.09 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.635 1.174 . . . . 0.0 111.848 174.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.95 -31.03 38.18 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.861 1.264 . . . . 0.0 113.674 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.8 t -71.66 -42.94 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 120.844 -1.16 . . . . 0.0 111.232 175.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 mp -67.23 -47.52 70.56 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.647 0.779 . . . . 0.0 111.474 175.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.19 -47.76 65.38 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.688 1.195 . . . . 0.0 111.403 170.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -55.51 -41.7 73.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.08 -47.46 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.497 1.044 . . . . 0.0 111.521 171.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -60.0 -24.01 64.13 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.861 1.664 . . . . 0.0 114.148 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -58.32 -52.3 66.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.523 1.129 . . . . 0.0 111.465 167.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.9 t -75.03 -46.7 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.701 1.6 . . . . 0.0 111.902 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -138.12 112.11 8.45 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.941 0.897 . . . . 0.0 111.455 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.7 p -72.94 -14.71 61.51 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -132.43 76.91 71.29 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.516 2.326 . . . . 0.0 110.494 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.02 159.23 54.79 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.566 2.177 . . . . 0.0 112.547 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.68 166.76 52.41 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 123.725 0.678 . . . . 0.0 112.136 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 3.2 mp -64.12 -35.04 72.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 121.803 -0.822 . . . . 0.0 110.698 -174.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.53 -23.96 63.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.975 1.31 . . . . 0.0 113.143 175.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.8 mt -82.89 -37.44 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.152 0.981 . . . . 0.0 109.721 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 39.4 mt -63.06 -47.88 81.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.874 0.869 . . . . 0.0 111.041 167.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -64.72 -35.75 82.06 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 172.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -53.67 -51.89 61.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.946 1.703 . . . . 0.0 110.982 166.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -57.9 -45.7 86.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 173.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.82 -53.22 59.32 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.999 0.818 . . . . 0.0 112.163 175.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -69.8 -27.84 65.23 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.9 1.28 . . . . 0.0 113.553 -174.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -92.94 -24.21 18.48 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.117 1.326 . . . . 0.0 114.455 177.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.2 mt -93.83 -17.38 23.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.28 66.14 0.64 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.454 1.901 . . . . 0.0 111.759 -166.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.46 -175.62 3.64 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.533 2.333 . . . . 0.0 108.953 167.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 pm0 -119.07 153.39 34.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.091 1.756 . . . . 0.0 111.776 169.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.27 -46.48 35.89 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.329 1.852 . . . . 0.0 112.292 -173.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -51.64 -43.77 62.74 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.53 1.532 . . . . 0.0 114.469 175.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -66.61 -41.6 88.16 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.291 -0.88 . . . . 0.0 111.086 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -38.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 118.235 0.47 . . . . 0.0 111.422 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -60.77 -52.5 64.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.07 1.348 . . . . 0.0 111.852 173.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.67 -43.86 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.39 -0.819 . . . . 0.0 110.597 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.405 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 66.7 t90 -58.97 -56.65 19.5 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.617 1.099 . . . . 0.0 112.249 176.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -63.81 -39.52 94.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.119 0.872 . . . . 0.0 112.675 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -62.52 -47.83 82.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.599 1.091 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -60.18 -42.19 94.5 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.797 1.18 . . . . 0.0 111.771 174.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.405 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -62.45 -52.08 64.95 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.063 0.945 . . . . 0.0 113.05 178.608 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -41.83 98.27 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 117.099 -1.429 . . . . 0.0 111.142 176.02 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.63 -54.2 48.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.576 1.08 . . . . 0.0 112.345 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -55.24 -51.35 66.88 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 120.94 -1.1 . . . . 0.0 112.215 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -68.02 11.65 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 125.557 1.543 . . . . 0.0 114.553 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -126.97 -14.57 5.53 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 120.128 -1.608 . . . . 0.0 114.322 160.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -73.72 -53.44 10.35 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.128 1.371 . . . . 0.0 111.686 165.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.8 m -83.4 49.17 1.52 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.956 1.703 . . . . 0.0 113.675 -169.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -141.67 86.67 2.01 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.03 2.132 . . . . 0.0 106.568 161.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.76 -111.24 0.07 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.361 1.064 . . . . 0.0 110.863 -170.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -63.29 116.82 5.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.173 1.789 . . . . 0.0 112.505 173.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 m -77.31 62.67 2.38 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.65 1.18 . . . . 0.0 112.181 178.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -126.91 105.09 8.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.463 1.105 . . . . 0.0 112.696 -167.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -71.99 152.01 42.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.125 -0.359 . . . . 0.0 110.095 158.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.0 tp -105.64 -115.48 0.24 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.992 0.917 . . . . 0.0 110.819 -175.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.4 tmm? . . . . . 0 C--O 1.246 0.869 0 C-N-CA 126.715 2.006 . . . . 0.0 108.906 178.679 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.826 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -64.32 -71.17 0.19 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.728 2.011 . . . . 0.0 114.855 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -143.48 86.4 8.92 Favored Pre-proline 0 N--CA 1.484 1.237 0 C-N-CA 126.702 2.001 . . . . 0.0 110.56 -171.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -72.6 177.3 7.65 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.992 2.461 . . . . 0.0 112.6 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.37 141.58 8.7 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.621 -0.674 . . . . 0.0 111.581 169.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.6 m -125.71 144.56 50.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.64 0.776 . . . . 0.0 111.755 -163.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -124.97 173.58 8.56 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.567 1.547 . . . . 0.0 111.642 172.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -131.32 -173.19 3.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.543 2.337 . . . . 0.0 110.212 -174.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.0 t -63.14 147.99 49.26 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.479 -0.763 . . . . 0.0 110.397 160.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -53.02 -34.14 54.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.407 172.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -26.67 64.43 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.512 1.051 . . . . 0.0 112.909 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -82.67 -53.48 5.89 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 126.175 1.79 . . . . 0.0 110.12 171.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.7 mm -53.48 -44.15 55.08 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 C-N-CA 125.101 1.36 . . . . 0.0 111.328 -176.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -54.23 -40.9 68.12 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.805 1.184 . . . . 0.0 112.578 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.39 -46.31 90.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.452 -1.405 . . . . 0.0 110.768 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.3 mp -61.74 -48.89 78.66 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 174.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.21 -52.05 60.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.992 1.717 . . . . 0.0 112.669 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -71.92 -20.33 61.78 Favored 'General case' 0 CA--C 1.553 1.082 0 CA-C-N 119.098 0.863 . . . . 0.0 112.396 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.7 t -68.0 -55.3 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 119.876 1.217 . . . . 0.0 111.329 161.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -53.85 -38.92 65.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.758 1.623 . . . . 0.0 112.775 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.4 ttt85 -56.16 -24.38 40.88 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 127.102 2.161 . . . . 0.0 114.768 172.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.82 -26.36 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 126.111 1.764 . . . . 0.0 112.524 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -135.48 96.12 3.4 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.367 1.467 . . . . 0.0 111.18 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 71.6 m -64.89 -9.97 25.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.067 1.747 . . . . 0.0 114.876 -176.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -157.51 88.96 2.48 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 126.537 1.935 . . . . 0.0 109.642 169.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.37 161.24 43.12 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.798 1.665 . . . . 0.0 112.196 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.04 166.33 48.34 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.625 0.631 . . . . 0.0 113.31 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.12 -43.16 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.052 0.941 . . . . 0.0 112.148 -172.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -70.57 -20.14 62.81 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -176.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.6 mm -79.37 -38.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.52 1.128 . . . . 0.0 110.744 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.8 mt -64.52 -43.94 92.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.84 0.856 . . . . 0.0 111.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -58.64 -50.75 72.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.948 1.699 . . . . 0.0 113.208 167.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -55.09 -42.33 72.73 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.277 1.399 . . . . 0.0 112.249 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 mt -62.77 -46.82 86.24 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.506 -0.746 . . . . 0.0 112.206 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.73 -52.27 66.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.356 0.98 . . . . 0.0 111.817 177.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.36 -44.46 80.13 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.319 1.848 . . . . 0.0 112.616 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -101.89 -15.1 16.97 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -167.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.4 mt -95.31 -5.76 42.78 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.912 1.285 . . . . 0.0 113.039 171.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 53.63 71.3 0.51 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.647 1.979 . . . . 0.0 112.521 -165.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.6 mt -133.41 -178.8 5.15 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.164 2.185 . . . . 0.0 109.558 171.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.59 141.5 47.68 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.155 0.982 . . . . 0.0 110.385 173.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -46.39 -51.94 13.93 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.663 1.585 . . . . 0.0 111.9 -175.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -57.65 -41.97 82.54 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.194 0.998 . . . . 0.0 112.812 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.13 -35.33 80.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.596 -1.315 . . . . 0.0 111.758 174.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.6 mt -73.12 -38.3 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.228 0.922 . . . . 0.0 111.857 175.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -57.67 -56.19 25.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.883 1.22 . . . . 0.0 111.979 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.2 mp -59.26 -37.81 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 117.297 -1.335 . . . . 0.0 110.889 174.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 80.7 t90 -55.58 -63.83 1.04 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.054 1.752 . . . . 0.0 111.164 170.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -55.72 -45.14 78.0 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.685 1.129 . . . . 0.0 112.354 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.96 -37.19 86.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 118.282 -0.866 . . . . 0.0 112.736 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -62.21 -46.69 87.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.178 1.354 . . . . 0.0 111.57 171.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -55.06 -53.76 51.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.086 0.857 . . . . 0.0 111.559 176.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -60.53 -44.85 95.62 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.706 0.802 . . . . 0.0 112.111 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.61 -48.42 81.03 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 171.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.98 -43.48 98.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.049 1.34 . . . . 0.0 112.661 -178.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.25 -29.44 70.54 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.08 0.855 . . . . 0.0 112.3 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -80.66 -44.14 19.29 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 58.8 mtt85 51.94 -161.6 0.09 Allowed 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.178 1.391 . . . . 0.0 112.791 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.3 m -64.49 153.45 38.9 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.906 -1.121 . . . . 0.0 110.869 158.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -69.67 146.12 51.86 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.44 0.638 . . . . 0.0 111.939 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -148.16 98.16 2.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 -168.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -78.4 93.58 4.74 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -173.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 76.5 p -120.68 173.33 7.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.392 1.477 . . . . 0.0 112.63 168.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -138.96 -177.48 4.9 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.286 1.834 . . . . 0.0 110.197 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -146.95 163.88 34.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.977 0.911 . . . . 0.0 111.458 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.2 tp -138.59 -174.05 3.72 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.987 1.715 . . . . 0.0 111.856 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.3 ttt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.958 1.703 . . . . 0.0 111.424 179.039 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 109.989 -1.244 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.1 mtm105 -95.89 -170.66 2.17 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.379 1.472 . . . . 0.0 112.653 -169.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 64.7 169.52 0.1 OUTLIER Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 128.39 2.676 . . . . 0.0 114.219 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.42 176.85 9.12 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.964 2.443 . . . . 0.0 112.237 171.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.84 113.76 0.51 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.58 1.152 . . . . 0.0 109.488 162.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.4 m -95.14 158.81 15.3 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.818 1.247 . . . . 0.0 110.478 -176.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.82 171.38 14.3 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.939 1.696 . . . . 0.0 110.107 169.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -135.37 -170.01 2.51 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.79 2.036 . . . . 0.0 111.128 -178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -73.75 146.17 44.55 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.223 -0.923 . . . . 0.0 110.979 159.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -56.88 -31.59 65.0 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.656 1.183 . . . . 0.0 113.586 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -21.97 63.46 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.188 -0.945 . . . . 0.0 113.071 173.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -75.41 -54.16 7.52 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.767 1.227 . . . . 0.0 108.687 164.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.5 mm -48.64 -50.47 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.003 1.321 . . . . 0.0 112.118 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -59.36 -26.92 65.48 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -64.54 -51.97 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 122.027 2.194 . . . . 0.0 110.471 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.87 -46.08 90.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 112.603 176.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.75 -49.06 66.24 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.779 1.232 . . . . 0.0 113.07 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -65.76 -15.31 62.73 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.5 t -83.43 -50.04 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 119.277 0.944 . . . . 0.0 111.193 161.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -55.5 -38.82 69.66 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.422 . . . . 0.0 113.999 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.61 -7.5 33.47 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.5 t -119.05 -35.18 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.981 1.712 . . . . 0.0 111.727 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -139.73 93.92 2.71 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 128.585 2.754 . . . . 0.0 109.229 179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.9 p -59.0 -26.39 64.47 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -140.88 106.1 6.28 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.43 1.892 . . . . 0.0 108.87 159.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.68 -179.83 5.82 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 123.265 2.643 . . . . 0.0 111.779 174.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.86 167.8 54.35 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.001 0.81 . . . . 0.0 114.299 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.0 mm -61.65 -41.55 90.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.005 0.922 . . . . 0.0 111.669 -176.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.52 -31.0 67.5 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 125.968 1.707 . . . . 0.0 112.832 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.8 mm -76.52 -38.78 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.577 0.751 . . . . 0.0 110.365 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.17 -44.6 96.25 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.539 -0.725 . . . . 0.0 112.063 170.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -65.26 -41.38 94.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.19 1.796 . . . . 0.0 114.34 172.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.66 -43.5 93.41 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.683 1.128 . . . . 0.0 111.736 172.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.1 mt -61.25 -42.03 97.92 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.591 -1.318 . . . . 0.0 111.704 172.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.86 -58.63 7.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.236 1.014 . . . . 0.0 111.239 174.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -64.99 -37.2 86.89 Favored 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -70.41 -41.86 72.38 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.497 -1.377 . . . . 0.0 114.483 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 47.4 mt -90.85 -1.91 57.8 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.112 1.365 . . . . 0.0 112.696 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 48.64 50.51 17.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.07 2.548 . . . . 0.0 113.895 -170.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.0 mt -108.57 171.83 7.19 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.223 1.809 . . . . 0.0 110.037 170.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -93.89 140.01 30.21 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.509 1.147 . . . . 0.0 110.927 159.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -16.01 59.37 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -173.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.33 -43.7 80.92 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.735 1.614 . . . . 0.0 111.355 170.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -63.35 -38.59 91.75 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.719 -1.238 . . . . 0.0 111.491 171.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.6 mt -69.42 -41.32 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.504 175.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -53.85 -52.67 59.68 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.289 0.95 . . . . 0.0 112.387 169.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.06 -42.43 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.302 172.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.1 t90 -56.81 -52.99 62.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 121.013 1.733 . . . . 0.0 112.283 175.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -61.8 -48.54 80.14 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 118.417 0.553 . . . . 0.0 112.239 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -55.48 -39.7 70.74 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.441 1.019 . . . . 0.0 112.136 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -61.31 -43.12 99.39 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.343 -1.473 . . . . 0.0 112.779 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -58.95 6.21 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.148 0.885 . . . . 0.0 111.75 171.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -30.23 71.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.76 0.824 . . . . 0.0 111.715 -172.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.66 -58.11 9.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.924 . . . . 0.0 112.028 165.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.92 -50.38 61.23 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.762 0.825 . . . . 0.0 111.32 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.1 tt -58.1 -10.2 1.78 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.666 1.986 . . . . 0.0 114.726 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 7.06 7.7 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 170.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.46 ' HG2' ' H ' ' A' ' 59' ' ' SER . 14.0 ttt85 -76.2 -169.26 1.11 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.484 1.914 . . . . 0.0 109.63 162.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 58' ' ' ARG . 6.0 m 22.06 79.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 128.24 2.616 . . . . 0.0 114.585 154.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -71.65 61.86 0.38 Allowed 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -162.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -151.1 80.43 1.31 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 128.93 2.892 . . . . 0.0 108.631 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -162.77 152.59 15.88 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.448 1.899 . . . . 0.0 108.211 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.2 m -68.89 88.57 0.39 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.614 1.097 . . . . 0.0 112.588 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -54.41 -66.57 0.38 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.598 1.559 . . . . 0.0 113.616 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -145.47 110.14 5.07 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.049 1.339 . . . . 0.0 111.214 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.2 mt 50.18 59.43 4.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.762 1.625 . . . . 0.0 112.601 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.12 1.768 . . . . 0.0 110.671 -174.106 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.036 0 N-CA-C 108.119 -1.992 . . . . 0.0 108.119 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 0.58 -91.62 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 129.469 3.108 . . . . 0.0 114.984 173.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -162.26 84.1 1.61 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 0.0 110.164 -167.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.494 ' C ' ' H ' ' A' ' 6' ' ' THR . 71.7 Cg_endo -72.89 82.37 1.52 Allowed 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.195 2.596 . . . . 0.0 111.301 179.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.92 -6.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 129.626 3.171 . . . . 0.0 116.805 -172.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.494 ' H ' ' C ' ' A' ' 4' ' ' PRO . 75.5 m 32.96 -84.59 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 130.443 3.497 . . . . 0.0 113.331 -161.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 48.45 171.03 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 128.083 2.553 . . . . 0.0 115.428 -168.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -137.58 -174.72 3.85 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.642 1.977 . . . . 0.0 110.276 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -66.79 148.83 51.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.878 0.471 . . . . 0.0 110.701 159.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -57.49 -31.65 66.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.902 0.774 . . . . 0.0 112.158 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -14.16 60.22 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -90.32 -43.75 10.14 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.185 1.794 . . . . 0.0 110.738 168.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.7 mm -55.38 -53.64 33.54 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 C-N-CA 125.006 1.323 . . . . 0.0 110.684 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -58.14 -32.15 67.89 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.125 1.329 . . . . 0.0 114.109 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.73 -45.18 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 120.086 1.312 . . . . 0.0 110.425 173.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.59 -48.06 76.35 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.782 1.233 . . . . 0.0 112.042 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.76 -45.21 78.13 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.964 1.705 . . . . 0.0 111.628 170.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -61.9 -27.09 68.56 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.55 -47.8 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 CA-C-N 120.082 1.31 . . . . 0.0 111.643 166.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -54.91 -32.77 61.43 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.561 1.073 . . . . 0.0 113.027 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -57.23 -25.63 59.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.061 2.545 . . . . 0.0 115.021 171.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.35 -31.03 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.173 1.389 . . . . 0.0 114.263 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -131.71 76.39 1.71 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.536 1.934 . . . . 0.0 109.423 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.1 p -59.71 -27.02 66.09 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -128.79 106.64 18.51 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 126.345 1.858 . . . . 0.0 108.452 156.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.15 -172.3 1.41 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.482 3.455 . . . . 0.0 112.462 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.66 164.81 33.16 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.351 0.977 . . . . 0.0 113.011 167.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 24.9 mm -64.19 -38.17 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 121.753 -0.851 . . . . 0.0 111.636 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.26 -28.07 68.91 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.823 0.849 . . . . 0.0 112.936 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 24.6 mm -79.53 -37.93 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.474 1.51 . . . . 0.0 110.413 175.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.5 mt -61.44 -49.96 74.72 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.134 168.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.08 -46.65 78.95 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.287 1.435 . . . . 0.0 113.38 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.401 ' CG ' ' HZ1' ' A' ' 37' ' ' LYS . 24.1 t70 -65.04 -38.4 90.74 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 178.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -65.98 -46.92 76.29 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.652 -0.655 . . . . 0.0 111.311 170.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.05 -47.81 77.21 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.759 1.223 . . . . 0.0 111.951 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -52.41 -69.48 0.11 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 0.0 111.561 167.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.401 ' HZ1' ' CG ' ' A' ' 33' ' ' ASP . 63.0 mttt -66.85 -18.87 65.59 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -166.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.0 mt -102.34 -2.89 28.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.294 1.438 . . . . 0.0 113.455 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 45.74 62.18 2.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.169 2.187 . . . . 0.0 112.31 -169.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.6 mt -144.41 114.27 7.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.613 1.965 . . . . 0.0 109.029 179.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 pm0 -60.37 150.67 30.02 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.353 0.979 . . . . 0.0 113.233 -174.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.8 -33.61 49.77 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 124.629 1.172 . . . . 0.0 113.578 -171.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -55.89 -48.83 74.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.728 1.611 . . . . 0.0 112.057 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -62.9 -44.79 95.16 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.482 -1.386 . . . . 0.0 111.706 175.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 34.6 mm -67.29 -35.16 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.659 0.663 . . . . 0.0 111.673 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -57.7 -57.92 10.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.22 1.408 . . . . 0.0 111.41 168.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.0 -32.33 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.435 1.016 . . . . 0.0 111.627 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -63.07 -56.15 19.37 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.459 -1.4 . . . . 0.0 112.196 171.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -58.62 -42.36 88.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.983 0.81 . . . . 0.0 111.962 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -53.85 -55.24 28.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.219 1.407 . . . . 0.0 111.055 171.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -73.98 10.9 1.02 Allowed 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.74 -61.03 1.45 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.577 1.951 . . . . 0.0 110.141 159.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -45.31 89.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.952 1.301 . . . . 0.0 112.744 -178.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.52 64.9 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.346 0.658 . . . . 0.0 112.578 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -65.65 -51.92 55.75 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.2 -0.938 . . . . 0.0 110.922 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.2 mp -59.75 -26.9 66.05 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -60.67 -61.63 2.45 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 111.575 168.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.3 ttp85 -78.91 -13.4 59.82 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.5 t -66.92 169.59 7.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.229 1.412 . . . . 0.0 112.229 176.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -138.67 133.75 32.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 0.0 110.031 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.35 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.486 1.914 . . . . 0.0 111.949 -161.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -136.85 69.57 1.41 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.903 1.681 . . . . 0.0 108.487 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.8 p -81.41 55.26 2.55 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.208 -1.558 . . . . 0.0 113.272 -176.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.43 177.74 3.82 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.761 1.624 . . . . 0.0 112.424 168.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -135.32 168.87 18.39 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.911 1.284 . . . . 0.0 111.205 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.8 5.34 5.03 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.883 1.809 . . . . 0.0 115.883 -162.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 20.8 mmt . . . . . 0 C--O 1.247 0.931 0 C-N-CA 125.813 1.645 . . . . 0.0 111.384 173.511 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.274 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 83.1 mtm-85 -146.79 -55.97 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.826 2.05 . . . . 0.0 113.034 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 148.87 97.36 Favored Pre-proline 0 N--CA 1.476 0.845 0 C-N-CA 124.523 1.129 . . . . 0.0 111.817 -173.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.49 115.11 3.18 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.94 1.76 . . . . 0.0 109.915 158.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.04 147.38 16.42 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.206 -0.934 . . . . 0.0 112.632 166.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 m -143.56 -20.62 0.6 Allowed 'General case' 0 N--CA 1.474 0.758 0 O-C-N 124.749 1.281 . . . . 0.0 112.949 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.66 93.65 0.73 Allowed 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.259 -1.526 . . . . 0.0 110.712 160.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -68.36 -166.75 0.07 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.151 2.98 . . . . 0.0 112.666 177.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -72.62 147.19 46.04 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.089 -1.007 . . . . 0.0 111.282 163.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -57.01 -36.87 70.93 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.61 -9.06 23.67 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.21 -46.12 6.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.405 1.882 . . . . 0.0 111.656 162.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mm -52.68 -43.25 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.171 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -60.25 -36.81 78.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.69 1.196 . . . . 0.0 113.276 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -48.15 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.16 0.891 . . . . 0.0 110.003 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.02 -46.19 90.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.599 1.159 . . . . 0.0 111.839 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.58 -41.67 97.74 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.697 1.199 . . . . 0.0 113.318 171.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.8 -42.28 79.25 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.845 1.657 . . . . 0.0 113.347 172.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.13 -50.22 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.411 1.005 . . . . 0.0 111.006 172.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -57.79 -33.93 69.07 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.798 1.639 . . . . 0.0 113.912 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -55.6 -52.45 63.75 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.213 2.205 . . . . 0.0 110.713 173.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.6 t -72.02 -42.28 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.474 1.51 . . . . 0.0 112.151 178.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -146.16 110.96 5.22 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.688 1.195 . . . . 0.0 112.887 -176.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 82.6 m -57.49 -24.66 57.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.333 1.453 . . . . 0.0 114.779 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -134.5 92.05 20.92 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.933 1.293 . . . . 0.0 112.237 -174.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -70.16 178.07 5.21 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.587 2.858 . . . . 0.0 113.471 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.4 -178.69 21.27 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 126.177 1.846 . . . . 0.0 112.628 169.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.32 -51.68 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.711 0.804 . . . . 0.0 111.414 -173.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -29.89 71.06 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.592 1.157 . . . . 0.0 112.305 -176.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.7 mt -71.74 -43.81 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.751 0.82 . . . . 0.0 109.555 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.21 -43.94 96.72 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.605 -0.684 . . . . 0.0 111.952 172.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.23 -35.87 80.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.654 1.181 . . . . 0.0 113.901 174.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -61.98 -47.3 85.42 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.117 1.326 . . . . 0.0 111.728 169.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.22 -48.44 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.669 0.787 . . . . 0.0 111.243 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.82 -56.03 21.25 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.451 1.1 . . . . 0.0 111.734 172.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -53.76 -23.73 12.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.203 1.801 . . . . 0.0 113.623 176.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -107.69 -2.7 19.88 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.976 1.71 . . . . 0.0 115.289 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.1 mt -134.5 -13.52 2.3 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -173.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.1 29.22 4.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.505 1.922 . . . . 0.0 114.853 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.3 mt -95.9 166.84 11.59 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.597 1.559 . . . . 0.0 110.985 160.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.07 153.47 21.24 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.428 1.108 . . . . 0.0 112.877 159.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 tt -51.03 -39.1 55.08 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.237 1.415 . . . . 0.0 113.462 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.03 -41.08 77.95 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.538 1.517 . . . . 0.0 112.834 175.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.99 -30.03 61.06 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.773 -1.204 . . . . 0.0 111.667 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 36.5 mt -73.88 -39.35 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.513 0.725 . . . . 0.0 111.588 169.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -51.68 -56.82 11.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.816 1.247 . . . . 0.0 111.292 167.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.6 mt -58.61 -34.72 52.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.709 0.804 . . . . 0.0 112.056 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 79.1 t90 -61.92 -57.68 10.83 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.366 1.439 . . . . 0.0 110.953 171.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -58.68 -42.81 89.39 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -55.26 -53.06 60.87 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.338 1.055 . . . . 0.0 111.626 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -61.97 -48.38 80.63 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.949 1.25 . . . . 0.0 111.689 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -65.68 -35.38 80.61 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.206 -0.934 . . . . 0.0 113.309 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -43.24 67.4 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.106 1.321 . . . . 0.0 111.753 170.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.13 67.61 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.9 pttt -124.66 26.18 7.27 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.389 1.476 . . . . 0.0 113.043 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.0 tp -33.51 -47.19 0.21 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.132 2.573 . . . . 0.0 115.836 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -96.25 -9.73 29.64 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.289 1.588 . . . . 0.0 115.289 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -122.83 114.86 21.06 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 120.372 1.442 . . . . 0.0 113.299 -175.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 34.2 t -158.08 -175.13 5.18 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.0 1.32 . . . . 0.0 111.527 -171.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -58.37 -23.68 57.67 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 120.7 -1.25 . . . . 0.0 112.652 163.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 28.54 92.88 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.795 1 C-N-CA 131.857 4.063 . . . . 0.0 114.896 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -126.1 -11.94 6.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.674 1.99 . . . . 0.0 113.307 -167.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.6 t -140.61 174.07 10.88 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.18 0.991 . . . . 0.0 113.254 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -136.25 153.03 51.32 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.726 2.81 . . . . 0.0 110.245 -170.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -139.09 166.46 24.46 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -159.27 0.91 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.577 2.351 . . . . 0.0 111.773 -174.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 58.5 ttm . . . . . 0 C--O 1.252 1.197 0 C-N-CA 125.631 1.572 . . . . 0.0 110.852 177.714 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -62.01 -15.36 43.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 -161.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.6 ttp-105 -137.21 61.17 31.77 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-N 121.453 1.933 . . . . 0.0 114.051 -174.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.35 130.51 21.29 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 122.801 2.334 . . . . 0.0 112.153 -175.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -79.64 57.31 2.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.25 1.42 . . . . 0.0 111.494 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.0 m -70.08 76.83 0.5 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.585 1.554 . . . . 0.0 113.913 -168.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -85.19 172.38 11.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.654 1.181 . . . . 0.0 111.731 161.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.508 ' H ' HD13 ' A' ' 13' ' ' ILE . 5.9 m-85 -133.59 -174.3 3.48 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.535 2.734 . . . . 0.0 110.534 176.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.6 t -73.46 145.92 45.36 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.555 1.142 . . . . 0.0 111.504 168.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -55.82 -37.39 68.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.567 1.076 . . . . 0.0 113.717 -172.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -27.98 65.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 120.447 1.476 . . . . 0.0 112.719 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -82.22 -49.8 9.71 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.819 1.247 . . . . 0.0 111.041 169.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.508 HD13 ' H ' ' A' ' 8' ' ' PHE . 20.4 mm -49.93 -46.56 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 118.064 -0.97 . . . . 0.0 112.447 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.56 -27.88 66.63 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.579 1.081 . . . . 0.0 113.147 -177.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.58 -50.89 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.8 1.182 . . . . 0.0 110.364 171.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.5 -43.75 93.13 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -56.67 -41.35 77.12 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.394 1.452 . . . . 0.0 111.671 170.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -58.12 -38.34 76.31 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.452 1.024 . . . . 0.0 113.661 172.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.96 -45.38 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.177 0.899 . . . . 0.0 111.356 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -59.12 -30.1 67.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.502 1.121 . . . . 0.0 113.953 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.7 mtp85 -57.04 -54.94 41.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.543 1.137 . . . . 0.0 112.205 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.5 m -79.5 -31.62 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -131.62 85.54 2.26 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.335 2.254 . . . . 0.0 111.229 -176.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -60.0 -30.72 69.32 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -129.63 102.83 17.88 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 126.591 1.957 . . . . 0.0 108.106 164.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -78.96 -175.93 3.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.914 3.076 . . . . 0.0 112.917 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.9 167.68 18.65 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 126.111 1.815 . . . . 0.0 113.201 167.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.4 mm -64.82 -35.52 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.498 1.119 . . . . 0.0 112.568 -171.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -64.73 -32.32 73.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.139 0.975 . . . . 0.0 112.881 176.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 mm -71.72 -37.48 62.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.863 0.865 . . . . 0.0 110.563 172.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 89.9 mt -67.14 -47.68 70.36 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.75 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.63 -53.65 44.13 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 120.02 1.282 . . . . 0.0 113.399 167.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.95 -42.88 80.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.894 1.679 . . . . 0.0 112.61 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.71 -44.97 95.95 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.114 -0.991 . . . . 0.0 112.689 172.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.44 -58.67 6.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.318 1.047 . . . . 0.0 111.395 173.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -53.9 -44.18 70.3 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.11 1.364 . . . . 0.0 112.928 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -86.05 -6.58 59.0 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.2 mt -121.93 2.95 9.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.045 1.338 . . . . 0.0 113.45 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 t30 61.0 24.38 14.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.049 2.139 . . . . 0.0 114.039 -177.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.7 mt -95.85 173.09 7.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.345 2.258 . . . . 0.0 109.868 174.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -111.06 162.48 14.84 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.284 1.033 . . . . 0.0 113.337 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.6 tp -48.06 -48.07 33.47 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.504 1.522 . . . . 0.0 112.522 -176.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -60.49 -39.72 88.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.379 1.072 . . . . 0.0 112.319 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -61.93 -40.68 96.33 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.885 1.22 . . . . 0.0 111.102 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -40.41 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 118.693 0.679 . . . . 0.0 111.23 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.83 -55.62 24.94 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.268 1.027 . . . . 0.0 112.23 169.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.81 -39.25 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.411 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -60.66 -50.51 73.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.824 1.647 . . . . 0.0 111.797 175.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -65.65 -41.34 92.68 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.942 0.792 . . . . 0.0 111.769 178.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -60.4 -40.13 89.84 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.955 1.252 . . . . 0.0 111.997 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.84 -52.01 66.79 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.799 1.181 . . . . 0.0 111.702 169.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -44.86 94.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -35.11 73.02 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.784 -1.198 . . . . 0.0 111.709 175.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.98 91.84 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.704 1.138 . . . . 0.0 111.92 168.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -49.11 -29.09 4.81 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 126.897 2.079 . . . . 0.0 114.667 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.1 mp -68.81 -21.85 64.29 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -143.03 2.94 1.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -148.15 158.59 44.16 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.013 2.125 . . . . 0.0 109.24 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.4 m 62.16 -171.94 0.16 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.65 1.18 . . . . 0.0 112.756 -165.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 53.7 -159.23 0.15 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.744 1.618 . . . . 0.0 112.658 -165.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.41 77.53 1.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.141 1.776 . . . . 0.0 110.537 -178.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.71 72.89 9.43 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 122.246 1.022 . . . . 0.0 110.725 -171.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.3 m -149.56 175.28 11.66 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.317 1.847 . . . . 0.0 111.575 -177.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -72.4 89.36 1.24 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.135 0.974 . . . . 0.0 111.029 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -60.8 -19.34 59.36 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.63 96.86 0.19 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.966 0.803 . . . . 0.0 109.686 172.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.3 ttt . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.607 2.363 . . . . 0.0 111.161 -179.093 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.655 0 CA-C-O 118.606 -1.108 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -156.13 139.92 16.15 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.206 1.403 . . . . 0.0 110.546 172.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -119.59 53.41 2.41 Favored Pre-proline 0 N--CA 1.488 1.456 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -76.23 -177.84 3.98 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.21 2.607 . . . . 0.0 112.593 169.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.28 125.3 49.82 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.818 2.047 . . . . 0.0 109.108 174.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.5 m -136.15 138.66 42.2 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.437 0.695 . . . . 0.0 112.02 -170.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -150.21 174.89 12.3 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.096 2.158 . . . . 0.0 110.83 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.401 ' H ' HD13 ' A' ' 13' ' ' ILE . 8.8 m-85 -131.47 -163.36 1.32 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.405 2.282 . . . . 0.0 111.474 -167.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.6 t -73.16 150.88 41.8 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.701 0.8 . . . . 0.0 111.197 155.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.31 -33.27 74.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -167.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.91 -14.89 62.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.581 1.537 . . . . 0.0 113.198 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -78.39 -50.05 12.43 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.908 -1.12 . . . . 0.0 110.446 162.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.417 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 19.3 mm -48.34 -50.07 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.996 0.918 . . . . 0.0 112.051 175.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -60.6 -25.4 66.21 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.6 t -69.1 -43.42 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 120.078 1.308 . . . . 0.0 110.662 172.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 mp -65.82 -46.58 78.08 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.431 174.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -52.9 -47.2 68.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.716 1.143 . . . . 0.0 113.482 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -64.62 -27.2 68.77 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.4 t -71.99 -44.42 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.263 0.938 . . . . 0.0 111.508 164.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -56.42 -37.11 69.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.33 1.452 . . . . 0.0 113.353 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -69.91 -0.06 6.72 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.2 t -119.05 -37.29 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.069 1.748 . . . . 0.0 111.304 173.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -130.7 88.52 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.298 2.239 . . . . 0.0 110.163 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.73 -33.1 75.1 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.94 0.896 . . . . 0.0 112.77 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -122.78 87.97 50.18 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.901 1.68 . . . . 0.0 108.956 165.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -61.58 162.21 21.93 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.699 2.266 . . . . 0.0 114.538 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.73 164.08 44.64 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.017 0.818 . . . . 0.0 112.4 162.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.95 -39.1 70.23 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.817 0 C-N-CA 124.73 1.212 . . . . 0.0 111.103 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.31 -29.38 64.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.43 1.892 . . . . 0.0 112.972 -176.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.3 mt -69.58 -45.32 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 123.669 0.788 . . . . 0.0 109.168 170.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 14.9 mt -64.0 -43.37 95.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.553 0.741 . . . . 0.0 111.134 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.21 -35.99 80.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.446 1.498 . . . . 0.0 114.244 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.32 -44.97 93.42 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.706 -1.246 . . . . 0.0 112.05 168.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.63 -47.84 83.02 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.735 0.698 . . . . 0.0 111.912 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.82 -57.81 7.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 126.019 1.727 . . . . 0.0 111.189 174.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -44.83 84.43 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.529 0.731 . . . . 0.0 112.587 177.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -75.12 -15.85 60.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.572 1.549 . . . . 0.0 114.656 -177.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 88.8 mt -122.77 -2.82 8.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.671 1.189 . . . . 0.0 114.199 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 55.87 56.28 6.19 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.741 2.016 . . . . 0.0 112.565 -174.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 79.9 mt -131.05 156.45 45.16 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.442 2.297 . . . . 0.0 108.691 176.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -85.37 154.19 22.03 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.819 0.736 . . . . 0.0 112.574 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.35 -47.65 6.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.493 1.917 . . . . 0.0 112.658 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.1 -34.73 78.71 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -64.28 -39.22 93.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.678 2.035 . . . . 0.0 111.347 173.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -44.92 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.295 -0.86 . . . . 0.0 111.486 174.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.28 -54.26 47.5 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.579 1.081 . . . . 0.0 111.396 172.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -56.38 -42.33 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 O-C-N 120.559 -1.338 . . . . 0.0 110.739 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.417 ' HE1' ' CD1' ' A' ' 13' ' ' ILE . 81.1 t90 -57.08 -55.84 29.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 120.432 1.469 . . . . 0.0 112.492 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -61.73 -48.03 82.56 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.82 0.848 . . . . 0.0 112.606 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -59.0 -40.93 86.4 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 120.18 1.355 . . . . 0.0 111.884 174.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -62.59 -38.02 88.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.116 1.326 . . . . 0.0 111.605 172.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -52.71 60.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.053 0.941 . . . . 0.0 112.744 174.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -36.58 84.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.344 1.058 . . . . 0.0 111.71 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.43 -60.54 3.49 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.587 0.63 . . . . 0.0 111.299 164.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.473 ' HE3' ' HA ' ' A' ' 55' ' ' LYS . 0.3 OUTLIER -53.02 -44.47 67.36 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.083 1.753 . . . . 0.0 114.12 -176.643 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.12 -54.98 40.82 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.966 0.803 . . . . 0.0 110.428 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -64.21 -40.1 95.37 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 118.106 -0.95 . . . . 0.0 113.424 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 53.21 174.8 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.781 2.033 . . . . 0.0 112.87 -164.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 t -144.53 77.07 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.407 1.083 . . . . 0.0 109.234 162.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.664 ' CG ' ' H ' ' A' ' 61' ' ' ARG . 12.6 t-80 60.79 -178.14 0.11 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.844 2.458 . . . . 0.0 114.748 -164.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.664 ' H ' ' CG ' ' A' ' 60' ' ' HIS . 27.9 mtm105 54.71 -172.5 0.05 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 128.794 2.838 . . . . 0.0 112.671 -158.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 50.27 62.17 2.81 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.318 1.847 . . . . 0.0 113.61 -167.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.3 t -149.64 164.86 34.0 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.16 1.384 . . . . 0.0 110.36 170.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.87 132.92 43.0 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.476 0.711 . . . . 0.0 111.83 -174.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -145.29 -175.86 4.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.207 1.403 . . . . 0.0 112.369 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp 51.69 -106.36 0.26 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.84 2.056 . . . . 0.0 114.539 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 96.0 mtp . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.25 1.82 . . . . 0.0 111.797 -162.95 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.104 0 N-CA-C 109.917 -1.273 . . . . 0.0 109.917 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.7 ptt-85 -126.94 130.13 49.49 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.789 1.294 . . . . 0.0 111.452 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 56.97 168.32 0.06 OUTLIER Pre-proline 0 CA--C 1.559 1.312 0 C-N-CA 125.601 1.56 . . . . 0.0 113.732 -167.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.25 -175.41 2.7 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.585 2.857 . . . . 0.0 113.873 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 47.94 83.02 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 127.066 2.147 . . . . 0.0 113.039 172.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.6 m -73.32 129.78 38.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.951 -1.093 . . . . 0.0 110.947 169.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -139.59 167.52 21.92 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.075 1.35 . . . . 0.0 110.937 166.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -130.48 -174.83 3.46 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.451 1.501 . . . . 0.0 113.21 -169.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.6 p -79.52 151.31 30.82 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.383 2.273 . . . . 0.0 111.285 171.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -56.75 -45.24 82.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -167.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.24 -21.38 63.82 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 121.578 1.99 . . . . 0.0 113.633 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -85.12 -38.59 18.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.794 1.238 . . . . 0.0 112.133 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 37.7 mm -57.7 -50.95 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.748 0.819 . . . . 0.0 111.392 171.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -66.05 -19.05 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -176.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 87.7 t -78.21 -42.77 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 120.384 -1.447 . . . . 0.0 110.653 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 71.8 mt -67.96 -48.91 64.55 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.488 1.115 . . . . 0.0 112.337 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -55.9 -40.52 73.17 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.768 1.227 . . . . 0.0 112.074 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -63.22 -25.35 68.29 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 174.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.59 -45.28 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.922 1.237 . . . . 0.0 111.215 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -53.9 -41.97 68.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.624 1.102 . . . . 0.0 112.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -6.36 23.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 175.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 61.0 t -110.58 -38.16 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.739 2.016 . . . . 0.0 111.303 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -141.36 97.41 3.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.107 2.163 . . . . 0.0 109.307 172.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 16.6 p -55.48 -33.21 63.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.936 0.894 . . . . 0.0 112.755 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.96 103.65 39.57 Favored Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 125.66 1.584 . . . . 0.0 109.39 161.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.64 179.93 5.13 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 124.201 3.267 . . . . 0.0 112.791 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.68 165.14 41.96 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.586 -0.696 . . . . 0.0 111.633 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -68.13 -36.36 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.595 1.198 . . . . 0.0 110.659 177.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.99 -36.32 74.71 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 170.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -73.47 -38.72 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.65 0.659 . . . . 0.0 110.378 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.17 -46.73 85.75 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.291 -0.88 . . . . 0.0 111.867 171.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.09 -51.12 67.39 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.749 1.619 . . . . 0.0 112.833 168.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -61.15 -41.62 97.08 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.412 1.005 . . . . 0.0 112.906 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -62.89 -45.83 90.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.572 0.749 . . . . 0.0 111.537 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.86 -53.07 62.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.062 0.945 . . . . 0.0 110.865 175.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -53.49 -40.45 65.35 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.822 1.649 . . . . 0.0 113.278 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.76 -12.74 18.1 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -174.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.1 mt -99.69 -4.84 29.92 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.37 1.068 . . . . 0.0 112.634 172.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.62 55.83 6.07 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.023 1.329 . . . . 0.0 110.819 -172.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.9 mt -126.11 177.8 6.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.981 2.112 . . . . 0.0 109.333 171.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -104.1 162.06 13.48 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.865 -1.147 . . . . 0.0 112.655 161.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.81 -50.37 7.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.861 2.064 . . . . 0.0 112.0 173.117 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -58.64 -47.63 83.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.804 1.641 . . . . 0.0 114.126 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 -63.94 -36.8 85.16 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 120.802 -1.186 . . . . 0.0 111.587 179.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.34 -42.09 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 118.512 -0.756 . . . . 0.0 112.313 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -52.13 -52.11 53.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.505 1.048 . . . . 0.0 111.434 169.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -59.1 -43.59 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 117.655 -1.164 . . . . 0.0 110.714 175.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 76.1 t90 -57.7 -55.1 39.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.959 1.709 . . . . 0.0 112.48 173.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -59.06 -46.57 87.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.342 0.973 . . . . 0.0 111.918 -177.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -65.04 -42.11 94.58 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.444 -0.785 . . . . 0.0 112.149 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -61.21 -38.33 86.22 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.391 1.451 . . . . 0.0 112.227 171.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -58.3 9.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.596 1.158 . . . . 0.0 112.929 173.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -41.33 84.16 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 119.749 1.159 . . . . 0.0 111.738 177.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -48.88 78.14 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.28 -44.63 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.941 1.297 . . . . 0.0 112.139 179.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.26 -28.31 69.94 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -175.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -86.16 -0.86 56.7 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 168.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 13.29 84.57 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 130.952 3.701 . . . . 0.0 114.217 -167.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 m -54.66 138.17 42.18 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.614 1.565 . . . . 0.0 112.084 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -149.65 175.14 11.82 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.868 1.667 . . . . 0.0 109.44 159.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -154.45 -177.61 6.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.975 2.11 . . . . 0.0 108.657 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -50.59 105.91 0.11 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.368 1.867 . . . . 0.0 113.932 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.9 t -147.18 169.67 18.85 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.016 1.726 . . . . 0.0 109.407 156.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -149.05 156.11 41.75 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.386 1.874 . . . . 0.0 109.836 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -79.54 -7.74 58.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 170.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.4 tp 44.77 -123.04 0.96 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.289 2.236 . . . . 0.0 111.12 -166.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.8 ptm . . . . . 0 C--O 1.251 1.166 0 C-N-CA 129.358 3.063 . . . . 0.0 108.811 176.522 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.131 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -146.1 17.42 1.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.722 1.209 . . . . 0.0 114.212 -175.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -112.87 86.55 9.03 Favored Pre-proline 0 N--CA 1.479 0.982 0 C-N-CA 125.478 1.511 . . . . 0.0 111.027 -176.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.77 72.43 4.5 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 124.084 3.19 . . . . 0.0 113.301 -169.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -100.29 137.48 38.66 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.603 1.561 . . . . 0.0 109.384 168.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 m -147.31 125.58 12.25 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.382 -0.824 . . . . 0.0 111.218 172.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.33 168.54 19.43 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.135 1.374 . . . . 0.0 110.918 168.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -127.66 -169.57 2.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.425 2.29 . . . . 0.0 110.5 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.0 t -62.65 144.39 56.32 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 121.338 -0.851 . . . . 0.0 109.938 158.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -56.05 -34.47 65.93 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.732 1.213 . . . . 0.0 112.909 176.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -70.72 -1.31 11.01 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 126.177 1.791 . . . . 0.0 113.991 173.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -104.25 -48.88 3.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.613 1.565 . . . . 0.0 110.116 159.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.5 mm -46.52 -46.06 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 124.627 1.171 . . . . 0.0 112.571 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -53.13 -38.08 62.36 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.3 t -66.22 -49.09 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 120.357 1.435 . . . . 0.0 109.985 176.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.24 -45.45 93.2 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.14 0.576 . . . . 0.0 112.55 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -61.16 -45.08 96.11 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 120.83 -1.169 . . . . 0.0 114.087 172.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -64.5 -25.82 68.16 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 120.65 1.568 . . . . 0.0 113.443 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.6 t -70.34 -53.56 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 120.254 1.388 . . . . 0.0 110.841 165.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -54.83 -30.46 57.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.91 1.284 . . . . 0.0 113.604 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -62.05 -23.12 66.29 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 128.325 2.65 . . . . 0.0 114.389 173.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.9 t -119.53 -30.26 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.91 1.684 . . . . 0.0 112.104 -173.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -142.77 96.99 3.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.317 1.447 . . . . 0.0 110.27 165.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -70.64 -8.28 50.58 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -145.77 76.2 12.88 Favored Pre-proline 0 CA--C 1.548 0.882 0 CA-C-N 119.334 0.97 . . . . 0.0 111.29 174.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -79.35 -173.38 1.85 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.108 3.205 . . . . 0.0 114.006 -170.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -94.89 173.33 31.85 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.46 1.505 . . . . 0.0 113.74 174.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.56 -41.37 92.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 C-N-CA 123.806 0.842 . . . . 0.0 111.988 -175.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.43 -36.95 72.04 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.972 0.909 . . . . 0.0 112.912 176.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.17 -42.15 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.106 0.866 . . . . 0.0 110.072 174.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 67.4 mt -62.55 -46.29 89.04 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 118.869 -0.586 . . . . 0.0 112.214 173.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -62.88 -43.8 97.82 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.776 1.631 . . . . 0.0 113.964 175.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.73 -35.54 81.41 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.275 1.398 . . . . 0.0 112.003 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -66.11 -50.4 64.16 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.271 -0.893 . . . . 0.0 111.89 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.45 -43.37 71.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.382 1.473 . . . . 0.0 112.252 177.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -56.29 -69.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.752 1.221 . . . . 0.0 112.016 167.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -69.08 -15.15 63.38 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -168.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.0 mt -120.71 3.48 10.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.976 1.311 . . . . 0.0 114.376 -176.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.77 71.92 0.48 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.993 2.117 . . . . 0.0 113.716 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.8 mt -141.38 165.7 26.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.95 2.1 . . . . 0.0 109.643 170.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.24 147.11 31.36 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.888 -1.133 . . . . 0.0 112.077 158.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -49.99 -35.54 24.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.989 0.916 . . . . 0.0 113.199 172.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.76 -42.2 75.11 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 112.381 174.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -74.97 -32.12 61.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.173 -0.955 . . . . 0.0 113.319 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 4.1 mm -66.72 -39.86 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.543 1.065 . . . . 0.0 111.298 168.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.81 -58.67 7.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.958 1.303 . . . . 0.0 110.716 171.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.5 mt -54.1 -38.51 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.524 1.056 . . . . 0.0 111.469 175.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.66 -59.45 5.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 120.193 1.36 . . . . 0.0 112.956 172.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -58.96 -43.39 91.3 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.139 0.882 . . . . 0.0 111.959 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -64.43 -42.87 95.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 111.644 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -62.54 -38.43 89.97 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.645 1.566 . . . . 0.0 111.713 172.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -61.54 2.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.544 1.138 . . . . 0.0 112.328 173.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -37.41 86.4 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.491 -0.766 . . . . 0.0 112.02 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.97 88.16 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.324 0.965 . . . . 0.0 112.852 172.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -70.77 -34.11 71.48 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.96 -1.087 . . . . 0.0 113.116 -177.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -50.02 -37.06 31.2 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.877 1.271 . . . . 0.0 112.713 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -74.92 -33.95 62.07 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.009 1.723 . . . . 0.0 114.453 177.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -129.83 68.26 1.44 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.664 1.986 . . . . 0.0 111.778 -175.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 34.6 t -159.94 152.8 21.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.114 1.366 . . . . 0.0 109.821 168.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.9 t60 61.37 166.43 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.778 2.431 . . . . 0.0 114.075 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -151.46 -16.11 0.2 Allowed 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 176.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.95 145.29 56.07 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.096 1.316 . . . . 0.0 111.861 168.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -127.9 91.38 3.27 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.929 0.892 . . . . 0.0 111.908 -159.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.9 91.99 0.89 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.774 1.629 . . . . 0.0 113.342 -174.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -113.33 155.27 25.46 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.883 1.673 . . . . 0.0 110.565 165.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.35 -93.16 0.16 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.441 1.096 . . . . 0.0 111.331 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 25.4 ttt . . . . . 0 C--O 1.252 1.195 0 C-N-CA 127.916 2.487 . . . . 0.0 109.436 -176.447 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 . . . . . 0 CA--C 1.541 0.629 0 CA-C-O 120.986 0.422 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.0 t -65.87 145.76 55.55 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.153 0.581 . . . . 0.0 110.268 155.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.07 -19.71 63.21 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.089 -1.007 . . . . 0.0 113.121 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.83 -14.22 62.89 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.783 1.233 . . . . 0.0 113.432 170.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -98.16 -43.14 7.12 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.78 2.032 . . . . 0.0 110.13 172.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.3 -46.49 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.093 0.957 . . . . 0.0 110.913 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.34 69.2 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.91 -46.5 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 120.022 1.283 . . . . 0.0 109.638 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.32 -45.32 91.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.458 1.103 . . . . 0.0 112.206 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -48.62 -58.74 4.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.674 1.59 . . . . 0.0 113.009 166.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -68.06 -19.26 64.86 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -174.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 71.8 t -73.75 -51.42 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.896 1.278 . . . . 0.0 111.684 162.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -53.84 -30.2 44.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.881 1.673 . . . . 0.0 113.396 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -50.18 -52.94 31.35 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.438 1.017 . . . . 0.0 112.344 167.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.69 -49.45 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 127.982 2.513 . . . . 0.0 111.148 -173.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -131.63 96.52 3.98 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 112.294 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.6 -12.19 14.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.01 -1.056 . . . . 0.0 113.773 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -146.76 103.95 3.92 Favored Pre-proline 0 CA--C 1.547 0.839 0 O-C-N 120.324 -1.485 . . . . 0.0 110.82 160.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -75.77 176.15 10.37 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.674 2.916 . . . . 0.0 113.478 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -100.78 176.93 27.68 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.65 1.595 . . . . 0.0 113.364 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.8 mm -62.5 -39.93 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -65.7 -32.85 74.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.115 0.87 . . . . 0.0 113.045 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.5 mm -71.74 -38.58 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 123.696 0.798 . . . . 0.0 110.679 172.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.31 -47.86 77.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.726 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -41.41 94.41 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.517 1.053 . . . . 0.0 113.478 170.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -56.61 -50.44 71.99 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.285 -1.509 . . . . 0.0 112.072 172.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.6 mt -61.54 -42.2 98.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.357 0.663 . . . . 0.0 112.25 174.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -53.5 57.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.674 1.19 . . . . 0.0 112.214 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -65.15 -29.85 70.72 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -81.74 -56.45 3.99 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.745 1.218 . . . . 0.0 113.747 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 89.6 mt -74.08 -10.13 59.32 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.341 1.456 . . . . 0.0 113.781 -171.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 48.4 70.27 0.47 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.409 1.884 . . . . 0.0 111.476 -159.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.9 mt -135.24 158.5 44.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.488 1.915 . . . . 0.0 108.573 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -88.02 145.68 25.87 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.266 1.426 . . . . 0.0 110.403 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.3 tt -48.49 -41.29 29.42 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -54.18 -49.22 69.81 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.183 1.393 . . . . 0.0 112.749 175.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -59.9 -40.46 88.86 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.895 -1.128 . . . . 0.0 111.969 175.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -74.95 -34.08 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 118.745 0.702 . . . . 0.0 112.446 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -57.45 -52.46 65.27 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.424 1.011 . . . . 0.0 111.786 167.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -57.8 -37.92 62.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.255 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -61.35 -58.72 7.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 120.83 1.65 . . . . 0.0 112.361 172.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -57.94 -42.06 84.1 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -70.53 -38.84 74.29 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 120.623 -1.298 . . . . 0.0 113.466 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -62.73 -32.77 73.95 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 121.02 1.736 . . . . 0.0 111.985 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.408 HH11 ' CG ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -57.37 -58.81 6.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.582 1.153 . . . . 0.0 113.074 172.907 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 -56.25 -50.09 72.33 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.363 0.665 . . . . 0.0 111.846 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.807 1.039 . . . . 0.0 113.807 174.031 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.2 t -67.86 140.79 56.56 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.918 1.687 . . . . 0.0 110.488 162.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.54 -32.84 65.52 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -61.96 -33.69 74.75 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.0 1.273 . . . . 0.0 113.461 175.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.09 -40.63 45.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.726 1.21 . . . . 0.0 111.403 174.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.61 -56.21 16.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.638 0 CA-C-N 118.518 0.599 . . . . 0.0 110.616 173.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.7 -10.64 57.56 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.6 t -82.25 -52.23 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.156 0.983 . . . . 0.0 110.838 161.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -57.62 -48.1 80.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.33 1.052 . . . . 0.0 112.797 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -58.31 -38.82 77.84 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.14 1.376 . . . . 0.0 112.444 171.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -60.47 -32.53 71.49 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.9 t -73.05 -50.96 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.266 0.939 . . . . 0.0 110.559 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -54.87 -28.7 52.12 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.825 1.25 . . . . 0.0 114.01 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -56.13 -63.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.328 1.851 . . . . 0.0 112.374 165.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.6 -35.14 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -141.72 106.24 4.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.22 1.408 . . . . 0.0 111.497 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -61.91 -26.25 68.06 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.898 -1.126 . . . . 0.0 113.344 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -121.77 96.4 47.18 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 127.343 2.257 . . . . 0.0 109.615 166.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -62.52 166.28 13.73 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.32 2.013 . . . . 0.0 111.78 167.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.55 165.27 54.37 Favored Glycine 0 CA--C 1.534 1.242 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 163.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.0 mm -62.07 -32.44 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 O-C-N 121.705 -0.88 . . . . 0.0 111.281 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.58 -29.25 69.83 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.873 1.669 . . . . 0.0 112.655 177.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 52.6 mt -80.5 -38.75 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 123.891 0.876 . . . . 0.0 109.655 174.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.3 mt -63.0 -43.04 99.87 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.487 -0.758 . . . . 0.0 111.649 171.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -55.64 32.28 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.497 -1.24 . . . . 0.0 112.728 164.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -55.67 -39.06 70.44 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.448 1.931 . . . . 0.0 112.889 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.84 -53.79 53.78 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.089 0.956 . . . . 0.0 111.452 170.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.07 -55.85 18.08 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.862 1.21 . . . . 0.0 112.186 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.8 mm-40 -54.91 -40.28 69.68 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.401 1.88 . . . . 0.0 111.808 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -27.13 30.91 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 178.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.9 -19.64 15.18 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 120.026 1.284 . . . . 0.0 114.048 -171.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 62.34 32.42 16.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.194 1.797 . . . . 0.0 113.764 -170.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.2 mt -90.96 171.54 9.21 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.803 150.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.04 163.67 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.333 1.063 . . . . 0.0 112.926 161.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.87 -51.74 4.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.711 2.004 . . . . 0.0 112.143 172.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -53.43 -55.36 25.84 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.202 1.801 . . . . 0.0 114.062 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.7 mtt85 -65.49 -34.41 78.22 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.202 -0.936 . . . . 0.0 111.504 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.2 mt -71.22 -41.19 74.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.033 0.833 . . . . 0.0 112.032 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -57.38 -53.44 58.08 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.155 1.343 . . . . 0.0 110.922 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.3 mt -56.06 -43.14 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.984 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -56.42 -56.56 19.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.349 1.431 . . . . 0.0 112.61 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -56.86 -48.61 77.71 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.596 0.759 . . . . 0.0 112.336 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -63.08 -44.23 96.33 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.018 -0.992 . . . . 0.0 111.181 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -62.85 -34.54 77.58 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.28 1.4 . . . . 0.0 112.78 174.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -65.45 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.837 1.255 . . . . 0.0 112.467 170.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -41.31 82.43 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 119.481 1.037 . . . . 0.0 113.298 177.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.003 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.998 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 . . . . . 0 CA--C 1.543 0.675 0 CA-C-O 122.092 0.948 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.0 t -76.31 153.65 35.71 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.188 -0.945 . . . . 0.0 111.657 161.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -53.97 -40.18 66.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 123.852 0.861 . . . . 0.0 112.787 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -63.9 -9.58 16.13 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -101.62 -38.25 8.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.297 1.839 . . . . 0.0 111.807 168.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -55.47 -51.85 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.12 0.968 . . . . 0.0 110.873 172.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -60.48 -29.85 69.32 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -176.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 64.7 t -70.56 -46.66 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 119.28 0.946 . . . . 0.0 110.652 172.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.1 mt -64.19 -46.75 82.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.624 1.17 . . . . 0.0 111.544 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -51.94 -53.27 43.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.702 . . . . 0.0 112.309 165.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -55.41 -30.21 60.01 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 178.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 92.0 t -72.54 -55.16 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 119.609 1.095 . . . . 0.0 111.039 166.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -51.84 -32.02 30.17 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.517 1.527 . . . . 0.0 113.873 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -67.04 -22.91 65.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.418 2.687 . . . . 0.0 114.662 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 m -117.52 -35.75 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.015 1.726 . . . . 0.0 113.096 174.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -114.55 78.32 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.491 1.916 . . . . 0.0 109.379 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.4 m -55.99 -20.37 16.2 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.568 1.547 . . . . 0.0 114.833 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -143.81 98.29 5.29 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.228 1.011 . . . . 0.0 109.678 165.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.91 169.54 20.12 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.45 2.1 . . . . 0.0 111.516 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.49 167.11 33.6 Favored Glycine 0 CA--C 1.532 1.121 0 O-C-N 121.762 -0.586 . . . . 0.0 112.4 169.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.27 -29.96 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 117.944 -1.027 . . . . 0.0 111.993 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -40.04 86.07 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.703 1.592 . . . . 0.0 112.963 171.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mm -69.82 -38.57 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 118.722 0.692 . . . . 0.0 110.929 173.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 79.3 mt -66.57 -45.34 79.62 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.377 -0.827 . . . . 0.0 112.55 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -52.8 -58.21 7.62 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.858 2.063 . . . . 0.0 112.458 165.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.39 -36.4 82.18 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.844 1.202 . . . . 0.0 112.877 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.1 mt -60.42 -48.09 83.28 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.649 1.113 . . . . 0.0 111.938 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.09 -56.23 23.31 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.797 1.239 . . . . 0.0 110.341 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.76 -2.78 1.93 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.557 1.943 . . . . 0.0 115.44 176.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -128.9 -18.34 3.81 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 120.753 1.615 . . . . 0.0 114.885 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -97.41 1.88 49.77 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.05 2.14 . . . . 0.0 111.987 163.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.3 t30 43.57 60.18 2.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 128.485 2.714 . . . . 0.0 113.843 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -119.39 173.76 6.77 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.691 2.796 . . . . 0.0 108.097 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 4.9 pm0 -96.73 166.62 11.56 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 120.814 -1.179 . . . . 0.0 112.637 164.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.6 tp -52.37 -47.38 66.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.419 177.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -53.46 52.75 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.063 0.847 . . . . 0.0 112.184 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.408 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 53.7 mtt180 -65.52 -30.01 70.71 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.709 1.141 . . . . 0.0 112.354 -173.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.4 mt -78.42 -39.97 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.632 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -54.35 -53.6 51.74 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 120.659 1.572 . . . . 0.0 112.627 170.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.74 -36.16 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 117.304 -1.332 . . . . 0.0 110.81 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -58.93 -61.55 2.55 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.511 1.96 . . . . 0.0 111.77 169.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -55.48 -49.9 71.29 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.087 0.858 . . . . 0.0 112.183 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -60.84 -35.39 76.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.294 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -64.26 -51.96 61.01 Favored 'General case' 0 C--N 1.347 0.5 0 CA-C-N 120.81 1.641 . . . . 0.0 111.604 171.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -58.75 -47.27 85.24 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 120.582 1.537 . . . . 0.0 111.545 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -35.12 79.35 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.94 1.296 . . . . 0.0 113.113 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.825 0 CA-C-N 119.466 1.03 . . . . 0.0 113.479 167.941 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 . . . . . 0 CA--C 1.549 0.912 0 CA-C-O 121.773 0.797 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.4 t -84.16 147.26 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.087 -1.008 . . . . 0.0 110.249 158.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -57.62 -32.25 67.04 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.67 1.123 . . . . 0.0 112.188 176.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.45 -31.5 62.0 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.461 1.504 . . . . 0.0 113.081 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -88.58 -41.51 12.63 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 126.175 1.79 . . . . 0.0 111.026 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.3 mm -51.99 -47.29 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.819 0.848 . . . . 0.0 110.849 171.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.75 -50.91 17.39 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.8 t -66.59 -41.33 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 O-C-N 121.37 -0.831 . . . . 0.0 111.002 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.07 -46.42 81.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.583 1.153 . . . . 0.0 112.361 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -66.01 -36.31 82.92 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.964 -1.085 . . . . 0.0 112.862 172.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -59.9 -32.45 70.76 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.99 -50.89 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.824 1.193 . . . . 0.0 111.358 168.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -53.3 -32.92 51.17 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.231 1.412 . . . . 0.0 113.5 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -60.03 -26.02 65.78 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.774 2.43 . . . . 0.0 114.064 173.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.7 t -108.09 -38.14 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 126.326 1.85 . . . . 0.0 111.884 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -127.53 85.21 2.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.481 1.513 . . . . 0.0 110.155 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -53.58 -33.02 53.34 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.518 1.527 . . . . 0.0 113.005 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -117.46 119.02 34.87 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 123.935 0.894 . . . . 0.0 109.426 154.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -75.74 172.01 17.1 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.392 2.728 . . . . 0.0 111.693 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.79 171.37 50.92 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 123.972 0.796 . . . . 0.0 112.221 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.8 mm -64.3 -48.56 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.736 -0.861 . . . . 0.0 110.307 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.58 -28.92 49.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.194 2.198 . . . . 0.0 113.878 173.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.7 mt -80.46 -34.8 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 123.727 0.811 . . . . 0.0 110.605 175.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -67.23 -45.59 76.32 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.868 0.867 . . . . 0.0 111.746 169.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.03 -54.99 36.02 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.093 1.757 . . . . 0.0 112.354 169.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -59.66 -43.59 93.88 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.282 0.946 . . . . 0.0 111.781 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.9 mt -62.41 -42.88 99.77 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 120.964 -1.085 . . . . 0.0 112.728 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.05 -58.63 7.57 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.225 0.921 . . . . 0.0 110.884 173.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -61.39 -32.86 72.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.8 1.24 . . . . 0.0 113.59 -176.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.7 tttp -90.46 -45.02 9.23 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.751 1.221 . . . . 0.0 113.524 -173.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.77 -12.0 60.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.325 1.05 . . . . 0.0 113.061 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 80.99 60.28 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.328 2.651 . . . . 0.0 110.488 171.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.3 mt -136.75 -164.48 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.785 2.834 . . . . 0.0 109.231 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.15 149.05 51.03 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.877 1.271 . . . . 0.0 110.691 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.56 -38.14 66.29 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.71 1.204 . . . . 0.0 113.452 -169.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -55.87 -42.01 75.24 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.598 1.09 . . . . 0.0 112.865 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -67.67 -37.62 82.61 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.114 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.4 mm -72.02 -38.59 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 118.606 0.639 . . . . 0.0 111.854 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.65 -57.5 12.13 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.17 1.388 . . . . 0.0 111.393 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.5 mt -57.38 -41.91 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.751 0.705 . . . . 0.0 110.826 175.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -59.59 -55.22 37.23 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.516 1.053 . . . . 0.0 112.858 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -62.75 -44.83 95.19 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.339 0.972 . . . . 0.0 111.135 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.79 -44.52 86.35 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.424 1.011 . . . . 0.0 111.59 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -60.34 -49.7 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.773 1.169 . . . . 0.0 112.194 173.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -58.07 9.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.136 0.974 . . . . 0.0 112.43 176.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -38.27 87.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.702 1.601 . . . . 0.0 111.867 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.625 0 CA-C-N 120.012 1.278 . . . . 0.0 112.165 171.789 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 CA--C 1.55 0.963 0 CA-C-O 122.309 1.052 . . . . 0.0 113.224 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -66.46 147.05 53.84 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.725 0.81 . . . . 0.0 110.41 158.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -52.09 -34.99 46.47 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.788 0.835 . . . . 0.0 112.717 172.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.13 -11.48 60.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -89.71 -44.69 9.84 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.338 1.855 . . . . 0.0 110.407 166.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.8 mm -54.69 -42.35 60.73 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 C-N-CA 125.4 1.48 . . . . 0.0 110.765 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -50.42 -47.45 56.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 173.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -67.61 -43.07 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.653 1.115 . . . . 0.0 110.081 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.87 -43.38 88.52 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.263 1.025 . . . . 0.0 112.213 -179.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.448 ' CD ' HH12 ' A' ' 52' ' ' ARG . 24.2 mt-10 -63.45 -43.36 97.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.724 1.147 . . . . 0.0 113.006 170.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -59.4 -36.5 75.94 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.8 t -71.45 -45.55 68.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 120.227 1.376 . . . . 0.0 111.483 171.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -54.3 -34.34 60.74 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.078 0.951 . . . . 0.0 113.047 176.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -54.02 -39.23 65.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.738 2.015 . . . . 0.0 113.733 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.91 -45.98 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.594 1.558 . . . . 0.0 110.821 174.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -130.17 88.45 2.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.8 1.64 . . . . 0.0 111.498 -168.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.9 m -58.01 -21.49 45.15 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -153.24 88.37 3.77 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.275 1.83 . . . . 0.0 108.58 172.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.96 177.91 8.16 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.52 2.813 . . . . 0.0 112.78 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.07 164.84 54.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.657 0.646 . . . . 0.0 113.744 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 27.3 mm -62.07 -43.38 97.63 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 O-C-N 121.97 -0.724 . . . . 0.0 112.311 -171.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.42 -23.73 64.61 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.389 0.995 . . . . 0.0 113.175 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 22.8 mm -81.71 -40.61 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.674 1.59 . . . . 0.0 110.173 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.67 -49.82 71.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.07 0.948 . . . . 0.0 111.624 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.98 -39.24 85.02 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 169.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.04 -48.46 67.6 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 120.799 1.636 . . . . 0.0 112.702 170.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.2 mt -67.69 -40.08 84.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.83 0.852 . . . . 0.0 112.12 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.63 -55.92 21.66 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.608 1.163 . . . . 0.0 110.992 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -62.9 -51.74 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.753 -0.592 . . . . 0.0 111.954 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -72.43 -8.35 54.58 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.6 mt -120.87 4.63 10.49 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.026 1.33 . . . . 0.0 112.382 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.8 t30 37.23 75.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.425 2.69 . . . . 0.0 112.684 -165.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.5 mt -135.89 164.78 27.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.039 2.536 . . . . 0.0 107.79 169.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -87.91 155.24 19.95 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 120.704 -1.248 . . . . 0.0 112.184 166.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -45.01 -49.91 11.03 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.38 1.872 . . . . 0.0 111.646 175.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.08 -39.13 77.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.643 1.177 . . . . 0.0 113.839 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.95 -43.22 79.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.749 -1.22 . . . . 0.0 111.141 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.5 mm -66.14 -42.01 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.621 0.646 . . . . 0.0 111.026 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -56.5 -52.09 66.05 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.318 0.963 . . . . 0.0 112.123 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -59.25 -37.68 70.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.25 -0.906 . . . . 0.0 111.58 173.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -60.66 -59.93 4.6 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 120.514 1.506 . . . . 0.0 112.267 171.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -55.17 -47.42 75.19 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.975 0.51 . . . . 0.0 111.59 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -62.66 -39.45 93.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 116.831 -1.557 . . . . 0.0 112.856 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -60.65 -40.04 90.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 121.427 1.921 . . . . 0.0 111.443 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.448 HH12 ' CD ' ' A' ' 17' ' ' GLU . 12.4 mmt85 -66.22 -55.46 16.08 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER -69.04 -18.4 64.01 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 177.809 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 CA-C-N 119.745 1.157 . . . . 0.0 111.368 162.311 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.538 0.516 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.6 t -57.07 145.96 29.03 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.634 -0.667 . . . . 0.0 111.042 162.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -58.81 -24.08 61.36 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.38 -41.16 96.66 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.372 0.987 . . . . 0.0 113.398 169.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -79.92 -30.68 40.08 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.156 0.982 . . . . 0.0 111.816 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mm -62.36 -49.14 85.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.478 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.281 168.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.26 -31.06 71.58 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.296 1.407 . . . . 0.0 114.213 -176.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 75.4 t -66.12 -46.82 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.018 0.826 . . . . 0.0 110.758 170.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.4 -43.08 86.78 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.305 1.042 . . . . 0.0 112.654 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -52.99 -52.57 57.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.846 1.658 . . . . 0.0 112.135 164.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -54.43 -46.42 73.23 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.899 0.772 . . . . 0.0 112.405 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 75.7 t -58.77 -52.02 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.362 172.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -56.23 -41.36 75.56 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.681 1.582 . . . . 0.0 112.177 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -61.73 -25.47 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.119 1.767 . . . . 0.0 113.521 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.6 t -100.65 -28.33 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.942 1.697 . . . . 0.0 112.284 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -140.96 83.6 1.89 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.59 2.356 . . . . 0.0 111.147 -171.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.5 m -57.42 -25.19 59.21 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -135.24 96.81 13.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.642 1.577 . . . . 0.0 109.944 166.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.92 163.61 38.29 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.472 2.115 . . . . 0.0 111.447 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.87 169.26 50.15 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.064 0.84 . . . . 0.0 113.176 172.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 mm -61.77 -38.64 80.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.695 -0.885 . . . . 0.0 111.937 -176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -30.19 69.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.955 1.302 . . . . 0.0 112.252 177.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.0 mt -71.65 -41.31 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 119.3 0.955 . . . . 0.0 110.038 170.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.02 -46.66 88.76 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.667 -0.646 . . . . 0.0 111.845 172.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -63.21 -37.9 89.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.686 1.595 . . . . 0.0 114.294 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -68.41 -38.81 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.016 -1.052 . . . . 0.0 111.924 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.14 -45.96 86.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.445 0.698 . . . . 0.0 111.329 170.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.87 -60.14 3.52 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.867 1.267 . . . . 0.0 111.388 174.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.4 tp60 -63.21 -27.02 69.07 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -107.48 -4.62 18.27 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -108.54 -6.53 16.05 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.77 2.028 . . . . 0.0 112.13 165.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.75 60.96 3.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.665 1.586 . . . . 0.0 111.388 -170.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.4 mt -131.53 155.24 47.79 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 127.372 2.269 . . . . 0.0 109.197 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.529 ' CD ' ' HE ' ' A' ' 44' ' ' ARG . 4.8 pm0 -76.36 142.89 41.04 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 122.784 1.278 . . . . 0.0 111.066 160.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.7 tt -50.58 -35.71 31.36 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 124.958 1.303 . . . . 0.0 111.594 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.33 -51.29 46.75 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.253 1.821 . . . . 0.0 113.229 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.529 ' HE ' ' CD ' ' A' ' 41' ' ' GLU . 85.9 mtt-85 -63.67 -41.55 98.16 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.559 -0.713 . . . . 0.0 111.395 176.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 48.5 mt -70.38 -37.2 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -61.35 -51.52 68.5 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.014 1.326 . . . . 0.0 110.533 172.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.4 mt -57.78 -42.49 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 118.079 -0.962 . . . . 0.0 110.404 173.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -58.1 -62.4 1.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.285 1.402 . . . . 0.0 112.277 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -55.6 -45.28 77.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.229 0.922 . . . . 0.0 112.519 -177.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -63.92 -38.61 91.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.534 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -60.96 -46.41 90.81 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.397 1.453 . . . . 0.0 112.502 170.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.94 -50.72 72.28 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.392 0.996 . . . . 0.0 111.866 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -57.02 -43.69 82.1 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.054 0.941 . . . . 0.0 112.166 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.847 0 CA-C-N 119.102 0.864 . . . . 0.0 113.071 173.482 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 121.692 0.758 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.33 144.42 53.99 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.962 -0.461 . . . . 0.0 109.792 156.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.32 -28.45 67.99 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.362 -1.461 . . . . 0.0 113.395 -174.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -68.84 -1.81 8.07 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.93 1.455 . . . . 0.0 114.93 170.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -104.82 -38.74 6.55 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.129 1.772 . . . . 0.0 111.031 166.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mm -55.43 -53.06 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.585 0.754 . . . . 0.0 111.352 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.92 -26.82 68.47 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -176.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.8 t -66.0 -51.44 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 120.405 1.457 . . . . 0.0 109.849 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -59.0 -47.12 86.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.608 0.763 . . . . 0.0 111.504 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.09 -30.32 66.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 117.183 -1.389 . . . . 0.0 114.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -66.28 -17.21 64.61 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 121.072 1.76 . . . . 0.0 112.948 166.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.62 -52.0 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 120.266 1.394 . . . . 0.0 111.859 161.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -55.47 -31.34 61.9 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.035 . . . . 0.0 113.722 178.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -53.27 -11.94 0.35 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 131.488 3.915 . . . . 0.0 115.423 168.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 44.2 t -132.77 -54.59 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 127.3 2.24 . . . . 0.0 110.703 175.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -100.87 92.0 4.85 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.731 1.613 . . . . 0.0 111.582 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.6 m -55.2 -32.35 62.15 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 176.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -144.69 97.33 5.01 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.386 1.875 . . . . 0.0 108.682 170.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -79.37 179.85 6.02 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.371 2.714 . . . . 0.0 113.116 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.21 162.16 54.46 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.253 0.93 . . . . 0.0 113.202 169.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 mm -68.04 -29.86 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 O-C-N 121.837 -0.802 . . . . 0.0 111.311 -178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.98 -33.47 75.81 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.373 1.869 . . . . 0.0 113.335 171.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.6 mm -71.42 -41.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 119.021 0.828 . . . . 0.0 110.434 170.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.44 -41.57 96.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.864 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.26 -50.41 74.09 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.876 2.07 . . . . 0.0 113.172 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -58.45 -41.02 84.19 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.595 1.089 . . . . 0.0 112.523 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.16 -48.64 72.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.053 0.941 . . . . 0.0 112.077 170.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -48.14 69.86 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.282 1.033 . . . . 0.0 111.864 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -55.88 -60.08 3.97 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.374 1.07 . . . . 0.0 112.394 171.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -65.43 -2.39 3.22 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.2 mt -128.26 -6.33 5.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.275 1.43 . . . . 0.0 113.701 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 43.45 73.15 0.15 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.067 1.347 . . . . 0.0 110.928 -158.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.45 -173.89 3.48 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.344 1.857 . . . . 0.0 109.199 171.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -137.2 150.13 47.68 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 125.273 1.429 . . . . 0.0 110.347 -177.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.2 tp -42.39 -54.34 3.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.796 1.239 . . . . 0.0 114.328 -171.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.07 -30.24 70.86 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.55 1.068 . . . . 0.0 113.684 -178.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -71.92 -37.5 70.04 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.962 1.255 . . . . 0.0 110.643 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -46.82 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.891 0.769 . . . . 0.0 111.454 171.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -54.37 -50.48 67.4 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.482 1.037 . . . . 0.0 112.135 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -62.3 -38.9 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 120.649 -1.282 . . . . 0.0 111.511 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -57.41 -57.34 13.08 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 120.324 1.42 . . . . 0.0 111.971 170.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -56.9 -48.58 77.89 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.286 1.034 . . . . 0.0 111.553 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -61.52 -41.29 97.1 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.07 0.948 . . . . 0.0 111.909 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.87 -41.53 95.6 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 120.512 1.506 . . . . 0.0 111.951 174.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -59.99 4.07 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.47 1.108 . . . . 0.0 112.079 172.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -54.08 -49.19 69.64 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.342 1.457 . . . . 0.0 111.45 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.679 0 CA-C-N 118.906 0.775 . . . . 0.0 112.895 175.922 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -76.59 152.71 35.83 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.074 0.95 . . . . 0.0 109.982 158.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -59.81 -38.71 82.72 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.435 -1.415 . . . . 0.0 113.044 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.83 -10.35 56.34 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -90.04 -47.43 7.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.771 1.628 . . . . 0.0 110.9 163.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.424 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 22.1 mm -50.94 -47.75 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.367 1.067 . . . . 0.0 111.972 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -61.02 -23.59 65.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.1 t -68.7 -50.76 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 120.063 1.301 . . . . 0.0 110.114 169.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.8 mp -62.13 -43.68 98.3 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 176.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.72 -42.45 79.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.778 -1.201 . . . . 0.0 113.651 169.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.5 -23.71 67.09 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 173.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.4 t -77.3 -47.0 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 119.91 1.232 . . . . 0.0 111.155 165.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -61.92 -30.96 71.24 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.85 1.66 . . . . 0.0 114.225 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -59.59 -17.99 37.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.076 1.307 . . . . 0.0 113.993 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.8 t -113.22 -37.64 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 126.556 1.943 . . . . 0.0 112.076 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -111.61 91.46 3.67 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.095 1.358 . . . . 0.0 112.274 -170.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -57.18 -30.5 64.56 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.472 -0.767 . . . . 0.0 112.868 167.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -139.46 114.83 8.18 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 127.854 2.462 . . . . 0.0 108.792 158.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -76.99 179.11 6.84 Favored 'Trans proline' 0 CA--C 1.55 1.31 0 C-N-CA 122.553 2.169 . . . . 0.0 110.724 167.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.71 166.02 39.07 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.442 -0.786 . . . . 0.0 113.196 170.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.2 mm -66.46 -36.89 78.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.848 -177.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.95 -26.56 68.27 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.608 1.549 . . . . 0.0 112.643 173.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.4 mm -74.55 -37.22 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.047 -1.033 . . . . 0.0 111.055 170.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 38.1 mt -67.5 -42.19 83.25 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.481 -0.762 . . . . 0.0 112.107 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.45 -49.02 77.59 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.788 1.635 . . . . 0.0 113.055 167.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -60.1 -43.41 95.59 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.458 1.026 . . . . 0.0 112.14 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.0 -45.89 93.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.883 0.873 . . . . 0.0 112.075 171.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.36 -51.56 67.86 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.228 1.011 . . . . 0.0 111.519 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -52.94 -63.51 1.12 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.944 1.297 . . . . 0.0 112.418 170.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -69.72 -13.67 62.41 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -171.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.75 1.76 13.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.465 1.106 . . . . 0.0 112.978 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 39.09 68.29 0.37 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.53 2.332 . . . . 0.0 112.856 -162.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.7 mt -120.45 -166.68 1.35 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.385 2.274 . . . . 0.0 109.036 171.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -134.19 159.19 41.66 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.812 -1.18 . . . . 0.0 110.504 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -44.69 -55.27 5.41 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.287 1.835 . . . . 0.0 112.2 -175.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -66.06 -27.37 68.04 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -65.88 -37.7 86.82 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 121.548 1.976 . . . . 0.0 110.766 171.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -41.71 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 118.342 0.519 . . . . 0.0 111.404 174.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -57.99 -52.99 63.22 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.099 0.863 . . . . 0.0 111.747 173.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.71 -36.14 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.96 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.424 ' HE1' ' CD1' ' A' ' 13' ' ' ILE . 71.2 t90 -61.89 -60.17 4.04 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.378 1.444 . . . . 0.0 112.218 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -59.74 -43.26 94.32 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.464 0.575 . . . . 0.0 111.385 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -49.03 79.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.918 175.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -59.16 -39.67 83.21 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.858 1.663 . . . . 0.0 111.461 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -62.98 1.43 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.194 0.998 . . . . 0.0 112.694 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.27 5.1 ptm180 -63.18 -35.36 80.05 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.992 1.269 . . . . 0.0 112.985 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 176.397 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 . . . . . 0 CA--C 1.539 0.557 0 CA-C-O 121.424 0.631 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.3 t -70.86 148.7 47.53 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.026 -0.421 . . . . 0.0 110.468 164.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -49.62 -41.9 43.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.615 1.966 . . . . 0.0 113.874 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -16.59 61.48 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 120.33 1.423 . . . . 0.0 113.838 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -84.12 -40.68 17.94 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.496 1.119 . . . . 0.0 110.32 167.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 mm -54.0 -51.59 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.104 0.962 . . . . 0.0 111.586 171.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.0 -37.24 66.34 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 85.3 t -66.67 -47.63 82.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.334 1.425 . . . . 0.0 110.857 174.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.76 -43.87 95.15 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.572 1.149 . . . . 0.0 112.22 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -49.87 -55.52 14.01 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.652 1.581 . . . . 0.0 111.087 164.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 -58.27 -12.94 4.15 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.899 1.815 . . . . 0.0 115.899 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 98.9 t -86.76 -49.62 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 120.714 1.597 . . . . 0.0 111.701 161.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -54.09 -30.53 48.83 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.342 1.057 . . . . 0.0 113.78 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -53.63 -28.13 31.11 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.783 1.233 . . . . 0.0 114.038 175.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.1 t -110.2 -48.92 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.876 2.07 . . . . 0.0 111.451 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -110.62 82.83 1.66 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.798 1.239 . . . . 0.0 111.667 -175.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.3 m -54.4 -33.88 60.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.272 -0.893 . . . . 0.0 112.501 169.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -124.9 103.03 31.05 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 126.757 2.023 . . . . 0.0 108.971 167.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -81.18 176.37 8.87 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.859 3.039 . . . . 0.0 112.739 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.94 163.45 31.92 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.519 1.057 . . . . 0.0 112.876 169.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.9 mm -59.43 -38.11 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.019 1.328 . . . . 0.0 111.127 -177.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.52 -27.57 61.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.759 2.024 . . . . 0.0 112.325 -177.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 57.5 mt -76.45 -39.85 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 170.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.5 mt -62.06 -46.18 90.25 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.682 0.793 . . . . 0.0 111.344 172.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.85 -49.93 75.02 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 165.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.47 -30.35 66.91 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.22 1.827 . . . . 0.0 114.614 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -70.57 -49.76 44.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.842 0.857 . . . . 0.0 112.263 167.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.37 64.07 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.671 1.189 . . . . 0.0 112.324 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.73 -12.36 46.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.595 2.758 . . . . 0.0 114.012 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -118.74 -34.89 3.83 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.849 1.26 . . . . 0.0 113.873 -176.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.9 mt -85.95 -13.36 47.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.96 0.904 . . . . 0.0 113.058 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 67.97 65.84 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.285 2.234 . . . . 0.0 111.856 -169.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.9 mt -139.36 177.93 7.56 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.221 2.208 . . . . 0.0 109.699 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -115.46 158.85 21.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.83 1.252 . . . . 0.0 112.002 165.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.19 -41.27 68.38 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.492 1.117 . . . . 0.0 113.796 -169.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -33.74 73.66 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.478 1.035 . . . . 0.0 113.257 176.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -68.69 -39.25 80.64 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.628 -1.295 . . . . 0.0 110.546 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.61 -47.72 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.04 171.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -54.65 -49.98 69.29 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.751 1.159 . . . . 0.0 111.912 175.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.5 mt -62.5 -38.04 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 117.558 -1.211 . . . . 0.0 111.222 174.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -58.44 -58.21 9.54 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 121.029 1.74 . . . . 0.0 111.542 170.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -54.1 -51.39 64.33 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 118.91 0.777 . . . . 0.0 112.743 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.54 -40.59 83.41 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 118.21 -0.9 . . . . 0.0 112.275 174.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -62.35 -46.66 87.67 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 120.771 1.623 . . . . 0.0 112.896 174.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -61.57 -46.79 88.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 120.151 1.341 . . . . 0.0 111.529 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -47.3 85.69 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.801 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.504 0 C-N-CA 124.54 1.136 . . . . 0.0 111.623 173.64 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 121.457 0.646 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.2 t -66.81 147.07 53.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.265 0.626 . . . . 0.0 110.784 166.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -55.17 -35.37 64.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.42 1.088 . . . . 0.0 113.218 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -5.53 32.34 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 125.266 1.427 . . . . 0.0 114.707 175.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -109.15 -33.3 6.92 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.49 1.916 . . . . 0.0 111.143 167.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -55.27 -51.96 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.28 1.032 . . . . 0.0 111.343 167.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -57.2 -34.42 68.5 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.7 t -69.1 -39.34 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 119.952 1.251 . . . . 0.0 110.173 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.6 mt -69.13 -46.99 66.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.376 1.07 . . . . 0.0 111.495 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -58.19 -39.22 78.37 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.093 0.86 . . . . 0.0 112.523 170.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -61.91 -27.97 69.2 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.843 -1.161 . . . . 0.0 114.121 172.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.2 t -76.5 -50.77 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 119.975 1.261 . . . . 0.0 111.098 166.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.57 -34.48 71.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.571 1.148 . . . . 0.0 113.62 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -65.25 -17.81 64.8 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 174.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.9 t -98.48 -45.81 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.759 1.623 . . . . 0.0 110.77 174.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -133.25 108.03 8.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.456 1.102 . . . . 0.0 112.952 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.5 t -51.3 -39.86 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.043 1.737 . . . . 0.0 113.002 169.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.38 92.52 20.55 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 126.278 1.831 . . . . 0.0 110.533 175.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.26 176.46 10.07 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 123.185 2.59 . . . . 0.0 112.636 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.96 170.52 45.57 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.679 1.133 . . . . 0.0 114.647 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 21.8 mm -66.44 -34.89 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.716 -0.873 . . . . 0.0 111.769 -175.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.16 -29.88 70.06 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.171 1.389 . . . . 0.0 112.574 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mm -76.22 -40.82 36.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.118 0.967 . . . . 0.0 109.698 174.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.47 -47.74 82.67 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.723 -0.61 . . . . 0.0 112.06 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.72 -55.92 26.56 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.963 1.305 . . . . 0.0 112.401 168.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -62.8 -22.23 66.48 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.24 -1.538 . . . . 0.0 114.013 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -76.42 -50.04 15.17 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.016 -1.052 . . . . 0.0 112.138 164.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.4 -53.28 47.05 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.374 1.47 . . . . 0.0 111.921 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -64.17 -12.7 42.65 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.221 1.408 . . . . 0.0 114.15 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 33.3 ttmt -123.23 -47.05 2.03 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.745 1.157 . . . . 0.0 114.002 -164.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.58 -17.06 61.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.526 1.13 . . . . 0.0 112.922 168.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 71.2 74.12 0.18 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.667 2.787 . . . . 0.0 111.191 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -142.3 175.44 9.76 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.367 1.867 . . . . 0.0 109.654 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -99.27 148.96 23.6 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 121.658 -0.652 . . . . 0.0 110.324 162.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 tt -42.83 -48.13 5.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.184 1.393 . . . . 0.0 112.937 175.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.09 -41.3 87.74 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -65.16 -34.87 79.41 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.595 -1.316 . . . . 0.0 111.646 175.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.0 mt -74.6 -42.51 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 118.703 -0.665 . . . . 0.0 112.177 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -52.49 -52.65 53.35 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.249 1.42 . . . . 0.0 111.882 170.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.82 -43.66 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 123.895 0.878 . . . . 0.0 110.693 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 84.4 t90 -55.87 -53.07 61.27 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.99 1.268 . . . . 0.0 112.496 172.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -59.03 -47.48 85.07 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 118.704 0.684 . . . . 0.0 111.671 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -47.22 83.84 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.288 0.949 . . . . 0.0 111.573 176.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -63.03 -39.4 94.64 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.986 1.266 . . . . 0.0 112.515 177.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.4 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -55.98 -54.63 42.51 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.74 -1.225 . . . . 0.0 112.547 168.95 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -28.75 67.17 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.276 1.43 . . . . 0.0 113.718 -175.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.841 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 167.665 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 120.948 0.404 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -75.79 152.5 37.32 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.515 -0.741 . . . . 0.0 110.434 164.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.09 -25.96 64.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -72.06 -3.07 20.87 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.981 1.719 . . . . 0.0 114.573 171.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -110.08 -33.41 6.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.635 1.974 . . . . 0.0 111.405 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mm -63.04 -44.53 99.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.595 0 CA-C-O 117.649 -1.167 . . . . 0.0 111.44 170.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -54.63 -43.89 72.67 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.69 1.586 . . . . 0.0 113.763 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 39.4 t -66.87 -39.98 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.091 0.859 . . . . 0.0 110.47 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.21 -46.35 64.71 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.461 1.105 . . . . 0.0 112.403 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -64.31 -36.13 83.12 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.775 -1.203 . . . . 0.0 112.609 171.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -59.34 -46.34 88.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.659 1.118 . . . . 0.0 112.601 169.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 87.8 t -64.76 -43.25 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 121.256 -0.903 . . . . 0.0 111.241 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -54.86 -43.0 72.72 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.704 1.138 . . . . 0.0 112.63 174.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -63.9 -13.1 42.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.362 2.265 . . . . 0.0 114.525 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.35 -41.96 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.955 1.702 . . . . 0.0 111.476 169.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -143.87 104.13 4.13 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.414 2.286 . . . . 0.0 110.234 -174.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 72.0 m -57.49 -22.26 42.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -158.78 82.47 2.62 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.702 2.001 . . . . 0.0 110.181 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.41 177.9 8.04 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.335 2.69 . . . . 0.0 111.956 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.43 167.31 54.81 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 121.785 -0.572 . . . . 0.0 114.337 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.1 mm -58.3 -47.34 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.802 0 C-N-CA 124.148 0.979 . . . . 0.0 111.667 -173.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -62.59 -26.13 68.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.132 0.973 . . . . 0.0 112.767 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.3 mm -74.47 -44.86 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.654 1.182 . . . . 0.0 110.285 172.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.3 mt -63.27 -39.77 95.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.878 0.871 . . . . 0.0 111.544 173.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -74.01 -33.82 63.94 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.181 1.393 . . . . 0.0 114.458 175.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.73 -41.8 91.72 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.932 1.696 . . . . 0.0 112.158 166.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -61.78 -51.29 68.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.321 0.648 . . . . 0.0 111.402 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.74 -44.06 66.17 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.209 1.004 . . . . 0.0 112.533 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -20.48 27.95 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.644 1.977 . . . . 0.0 114.864 177.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -118.31 -36.98 3.42 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.919 1.236 . . . . 0.0 113.53 -176.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.7 mt -73.61 -9.55 58.79 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.1 1.36 . . . . 0.0 113.456 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 48.26 77.29 0.1 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.509 2.324 . . . . 0.0 112.425 -165.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.86 -179.46 5.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.085 2.554 . . . . 0.0 108.35 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -112.59 159.59 18.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.693 1.597 . . . . 0.0 111.623 164.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.63 -46.67 40.18 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.077 1.351 . . . . 0.0 111.981 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -54.95 -53.42 55.85 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.81 1.244 . . . . 0.0 113.653 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -68.0 -31.8 71.75 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.092 0.86 . . . . 0.0 111.923 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -42.28 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.378 0.99 . . . . 0.0 111.029 169.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -57.74 -54.22 49.36 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.844 1.258 . . . . 0.0 112.019 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.53 -35.69 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.199 -0.938 . . . . 0.0 111.222 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -59.46 -56.45 21.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.724 1.602 . . . . 0.0 112.369 170.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.66 -43.23 94.0 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.858 0.863 . . . . 0.0 111.991 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -55.85 -47.63 76.94 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.854 1.262 . . . . 0.0 110.284 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -74.84 3.3 8.37 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 174.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.41 -64.27 1.17 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 109.921 152.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -45.3 72.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.722 1.209 . . . . 0.0 112.951 -172.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.014 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.776 0 CA-C-O 121.158 0.504 . . . . 0.0 112.229 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.9 t -59.34 146.52 39.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 0.0 111.078 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -55.67 -36.82 67.5 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.495 -0.753 . . . . 0.0 112.981 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -16.31 45.0 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.466 1.107 . . . . 0.0 113.192 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -99.09 -46.45 5.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.006 1.722 . . . . 0.0 111.132 170.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 mm -47.85 -49.09 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.635 1.174 . . . . 0.0 111.848 174.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.95 -31.03 38.18 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.861 1.264 . . . . 0.0 113.674 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.8 t -71.66 -42.94 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 120.844 -1.16 . . . . 0.0 111.232 175.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 mp -67.23 -47.52 70.56 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.647 0.779 . . . . 0.0 111.474 175.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.19 -47.76 65.38 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.688 1.195 . . . . 0.0 111.403 170.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -55.51 -41.7 73.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.08 -47.46 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.497 1.044 . . . . 0.0 111.521 171.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -60.0 -24.01 64.13 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.861 1.664 . . . . 0.0 114.148 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -58.32 -52.3 66.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.523 1.129 . . . . 0.0 111.465 167.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.9 t -75.03 -46.7 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.701 1.6 . . . . 0.0 111.902 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -138.12 112.11 8.45 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.941 0.897 . . . . 0.0 111.455 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.7 p -72.94 -14.71 61.51 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -132.43 76.91 71.29 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.516 2.326 . . . . 0.0 110.494 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.02 159.23 54.79 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.566 2.177 . . . . 0.0 112.547 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.68 166.76 52.41 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 123.725 0.678 . . . . 0.0 112.136 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.659 HD12 ' H ' ' A' ' 28' ' ' ILE . 3.2 mp -64.12 -35.04 72.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 121.803 -0.822 . . . . 0.0 110.698 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.53 -23.96 63.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.975 1.31 . . . . 0.0 113.143 175.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.8 mt -82.89 -37.44 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.152 0.981 . . . . 0.0 109.721 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 39.4 mt -63.06 -47.88 81.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.874 0.869 . . . . 0.0 111.041 167.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -64.72 -35.75 82.06 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 172.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -53.67 -51.89 61.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.946 1.703 . . . . 0.0 110.982 166.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -57.9 -45.7 86.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 173.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.82 -53.22 59.32 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.999 0.818 . . . . 0.0 112.163 175.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -69.8 -27.84 65.23 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.9 1.28 . . . . 0.0 113.553 -174.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -92.94 -24.21 18.48 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.117 1.326 . . . . 0.0 114.455 177.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.2 mt -93.83 -17.38 23.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.28 66.14 0.64 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.454 1.901 . . . . 0.0 111.759 -166.583 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.46 -175.62 3.64 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.533 2.333 . . . . 0.0 108.953 167.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 pm0 -119.07 153.39 34.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.091 1.756 . . . . 0.0 111.776 169.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.27 -46.48 35.89 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.329 1.852 . . . . 0.0 112.292 -173.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -51.64 -43.77 62.74 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.53 1.532 . . . . 0.0 114.469 175.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -66.61 -41.6 88.16 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.291 -0.88 . . . . 0.0 111.086 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -38.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 118.235 0.47 . . . . 0.0 111.422 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -60.77 -52.5 64.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.07 1.348 . . . . 0.0 111.852 173.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.67 -43.86 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.39 -0.819 . . . . 0.0 110.597 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.441 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 66.7 t90 -58.97 -56.65 19.5 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.617 1.099 . . . . 0.0 112.249 176.374 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -63.81 -39.52 94.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.119 0.872 . . . . 0.0 112.675 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -62.52 -47.83 82.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.599 1.091 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -60.18 -42.19 94.5 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.797 1.18 . . . . 0.0 111.771 174.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.441 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -62.45 -52.08 64.95 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.063 0.945 . . . . 0.0 113.05 178.608 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -41.83 98.27 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 117.099 -1.429 . . . . 0.0 111.142 176.02 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.774 0 CA-C-N 119.576 1.08 . . . . 0.0 112.345 172.759 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.0 t -63.14 147.99 49.26 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.479 -0.763 . . . . 0.0 110.397 160.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -53.02 -34.14 54.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.407 172.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -26.67 64.43 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.512 1.051 . . . . 0.0 112.909 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -82.67 -53.48 5.89 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 126.175 1.79 . . . . 0.0 110.12 171.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.412 HD12 ' HE1' ' A' ' 48' ' ' TRP . 18.7 mm -53.48 -44.15 55.08 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 C-N-CA 125.101 1.36 . . . . 0.0 111.328 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -54.23 -40.9 68.12 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.805 1.184 . . . . 0.0 112.578 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.39 -46.31 90.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.452 -1.405 . . . . 0.0 110.768 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.416 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 5.3 mp -61.74 -48.89 78.66 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 174.045 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.21 -52.05 60.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.992 1.717 . . . . 0.0 112.669 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -71.92 -20.33 61.78 Favored 'General case' 0 CA--C 1.553 1.082 0 CA-C-N 119.098 0.863 . . . . 0.0 112.396 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.7 t -68.0 -55.3 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 119.876 1.217 . . . . 0.0 111.329 161.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -53.85 -38.92 65.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.758 1.623 . . . . 0.0 112.775 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.4 ttt85 -56.16 -24.38 40.88 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 127.102 2.161 . . . . 0.0 114.768 172.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.82 -26.36 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 126.111 1.764 . . . . 0.0 112.524 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -135.48 96.12 3.4 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.367 1.467 . . . . 0.0 111.18 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 71.6 m -64.89 -9.97 25.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.067 1.747 . . . . 0.0 114.876 -176.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -157.51 88.96 2.48 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 126.537 1.935 . . . . 0.0 109.642 169.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.37 161.24 43.12 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.798 1.665 . . . . 0.0 112.196 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.04 166.33 48.34 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.625 0.631 . . . . 0.0 113.31 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.12 -43.16 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.052 0.941 . . . . 0.0 112.148 -172.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -70.57 -20.14 62.81 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -176.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.6 mm -79.37 -38.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.52 1.128 . . . . 0.0 110.744 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.8 mt -64.52 -43.94 92.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.84 0.856 . . . . 0.0 111.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -58.64 -50.75 72.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.948 1.699 . . . . 0.0 113.208 167.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -55.09 -42.33 72.73 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.277 1.399 . . . . 0.0 112.249 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 mt -62.77 -46.82 86.24 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.506 -0.746 . . . . 0.0 112.206 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.73 -52.27 66.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.356 0.98 . . . . 0.0 111.817 177.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.36 -44.46 80.13 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.319 1.848 . . . . 0.0 112.616 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -101.89 -15.1 16.97 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -167.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.4 mt -95.31 -5.76 42.78 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.912 1.285 . . . . 0.0 113.039 171.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 53.63 71.3 0.51 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.647 1.979 . . . . 0.0 112.521 -165.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.6 mt -133.41 -178.8 5.15 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.164 2.185 . . . . 0.0 109.558 171.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.59 141.5 47.68 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.155 0.982 . . . . 0.0 110.385 173.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -46.39 -51.94 13.93 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.663 1.585 . . . . 0.0 111.9 -175.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -57.65 -41.97 82.54 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.194 0.998 . . . . 0.0 112.812 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.13 -35.33 80.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.596 -1.315 . . . . 0.0 111.758 174.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.6 mt -73.12 -38.3 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.228 0.922 . . . . 0.0 111.857 175.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -57.67 -56.19 25.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.883 1.22 . . . . 0.0 111.979 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.2 mp -59.26 -37.81 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 117.297 -1.335 . . . . 0.0 110.889 174.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.416 ' CZ3' ' HB3' ' A' ' 16' ' ' LEU . 80.7 t90 -55.58 -63.83 1.04 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.054 1.752 . . . . 0.0 111.164 170.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -55.72 -45.14 78.0 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.685 1.129 . . . . 0.0 112.354 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.96 -37.19 86.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 118.282 -0.866 . . . . 0.0 112.736 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -62.21 -46.69 87.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.178 1.354 . . . . 0.0 111.57 171.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.408 ' HG3' ' CH2' ' A' ' 48' ' ' TRP . 18.1 mmm180 -55.06 -53.76 51.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.086 0.857 . . . . 0.0 111.559 176.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -60.53 -44.85 95.62 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.706 0.802 . . . . 0.0 112.111 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 171.101 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 CA--C 1.544 0.74 0 CA-C-O 121.677 0.751 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -73.75 146.17 44.55 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.223 -0.923 . . . . 0.0 110.979 159.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -56.88 -31.59 65.0 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.656 1.183 . . . . 0.0 113.586 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -21.97 63.46 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.188 -0.945 . . . . 0.0 113.071 173.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -75.41 -54.16 7.52 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.767 1.227 . . . . 0.0 108.687 164.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.5 mm -48.64 -50.47 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.003 1.321 . . . . 0.0 112.118 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -59.36 -26.92 65.48 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -64.54 -51.97 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 122.027 2.194 . . . . 0.0 110.471 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.42 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 2.6 mm? -59.87 -46.08 90.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 112.603 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.75 -49.06 66.24 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.779 1.232 . . . . 0.0 113.07 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -65.76 -15.31 62.73 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.5 t -83.43 -50.04 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 119.277 0.944 . . . . 0.0 111.193 161.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -55.5 -38.82 69.66 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.422 . . . . 0.0 113.999 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.61 -7.5 33.47 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.5 t -119.05 -35.18 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.981 1.712 . . . . 0.0 111.727 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -139.73 93.92 2.71 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 128.585 2.754 . . . . 0.0 109.229 179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.9 p -59.0 -26.39 64.47 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -140.88 106.1 6.28 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.43 1.892 . . . . 0.0 108.87 159.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.68 -179.83 5.82 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 123.265 2.643 . . . . 0.0 111.779 174.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.86 167.8 54.35 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.001 0.81 . . . . 0.0 114.299 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.0 mm -61.65 -41.55 90.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.005 0.922 . . . . 0.0 111.669 -176.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.52 -31.0 67.5 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 125.968 1.707 . . . . 0.0 112.832 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.8 mm -76.52 -38.78 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.577 0.751 . . . . 0.0 110.365 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.17 -44.6 96.25 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.539 -0.725 . . . . 0.0 112.063 170.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -65.26 -41.38 94.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.19 1.796 . . . . 0.0 114.34 172.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.66 -43.5 93.41 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.683 1.128 . . . . 0.0 111.736 172.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.1 mt -61.25 -42.03 97.92 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.591 -1.318 . . . . 0.0 111.704 172.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.86 -58.63 7.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.236 1.014 . . . . 0.0 111.239 174.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -64.99 -37.2 86.89 Favored 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -70.41 -41.86 72.38 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.497 -1.377 . . . . 0.0 114.483 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 47.4 mt -90.85 -1.91 57.8 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.112 1.365 . . . . 0.0 112.696 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 48.64 50.51 17.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.07 2.548 . . . . 0.0 113.895 -170.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.0 mt -108.57 171.83 7.19 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.223 1.809 . . . . 0.0 110.037 170.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -93.89 140.01 30.21 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.509 1.147 . . . . 0.0 110.927 159.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -16.01 59.37 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -173.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.33 -43.7 80.92 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.735 1.614 . . . . 0.0 111.355 170.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -63.35 -38.59 91.75 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.719 -1.238 . . . . 0.0 111.491 171.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.6 mt -69.42 -41.32 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.504 175.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -53.85 -52.67 59.68 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.289 0.95 . . . . 0.0 112.387 169.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.06 -42.43 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.302 172.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.424 ' CZ2' ' HD3' ' A' ' 52' ' ' ARG . 87.1 t90 -56.81 -52.99 62.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 121.013 1.733 . . . . 0.0 112.283 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -61.8 -48.54 80.14 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 118.417 0.553 . . . . 0.0 112.239 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -55.48 -39.7 70.74 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.441 1.019 . . . . 0.0 112.136 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -61.31 -43.12 99.39 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.343 -1.473 . . . . 0.0 112.779 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HD3' ' CZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -58.25 -58.95 6.21 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.148 0.885 . . . . 0.0 111.75 171.142 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -30.23 71.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.76 0.824 . . . . 0.0 111.715 -172.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.924 . . . . 0.0 112.028 165.663 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 CA--C 1.542 0.641 0 CA-C-O 120.794 0.33 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -66.79 148.83 51.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.878 0.471 . . . . 0.0 110.701 159.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -57.49 -31.65 66.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.902 0.774 . . . . 0.0 112.158 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -14.16 60.22 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.32 -43.75 10.14 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.185 1.794 . . . . 0.0 110.738 168.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.7 mm -55.38 -53.64 33.54 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 C-N-CA 125.006 1.323 . . . . 0.0 110.684 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -58.14 -32.15 67.89 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.125 1.329 . . . . 0.0 114.109 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.73 -45.18 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 120.086 1.312 . . . . 0.0 110.425 173.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.59 -48.06 76.35 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.782 1.233 . . . . 0.0 112.042 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.76 -45.21 78.13 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.964 1.705 . . . . 0.0 111.628 170.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -61.9 -27.09 68.56 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.55 -47.8 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 CA-C-N 120.082 1.31 . . . . 0.0 111.643 166.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -54.91 -32.77 61.43 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.561 1.073 . . . . 0.0 113.027 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -57.23 -25.63 59.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.061 2.545 . . . . 0.0 115.021 171.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.35 -31.03 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.173 1.389 . . . . 0.0 114.263 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -131.71 76.39 1.71 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.536 1.934 . . . . 0.0 109.423 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.1 p -59.71 -27.02 66.09 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -128.79 106.64 18.51 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 126.345 1.858 . . . . 0.0 108.452 156.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.15 -172.3 1.41 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.482 3.455 . . . . 0.0 112.462 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.66 164.81 33.16 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.351 0.977 . . . . 0.0 113.011 167.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 24.9 mm -64.19 -38.17 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 121.753 -0.851 . . . . 0.0 111.636 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.26 -28.07 68.91 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.823 0.849 . . . . 0.0 112.936 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 24.6 mm -79.53 -37.93 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.474 1.51 . . . . 0.0 110.413 175.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.5 mt -61.44 -49.96 74.72 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.134 168.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.08 -46.65 78.95 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.287 1.435 . . . . 0.0 113.38 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.04 -38.4 90.74 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -65.98 -46.92 76.29 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.652 -0.655 . . . . 0.0 111.311 170.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.05 -47.81 77.21 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.759 1.223 . . . . 0.0 111.951 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -52.41 -69.48 0.11 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 0.0 111.561 167.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -66.85 -18.87 65.59 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -166.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.0 mt -102.34 -2.89 28.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.294 1.438 . . . . 0.0 113.455 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 45.74 62.18 2.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.169 2.187 . . . . 0.0 112.31 -169.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.6 mt -144.41 114.27 7.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.613 1.965 . . . . 0.0 109.029 179.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 pm0 -60.37 150.67 30.02 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.353 0.979 . . . . 0.0 113.233 -174.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.8 -33.61 49.77 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 124.629 1.172 . . . . 0.0 113.578 -171.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -55.89 -48.83 74.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.728 1.611 . . . . 0.0 112.057 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -62.9 -44.79 95.16 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.482 -1.386 . . . . 0.0 111.706 175.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 34.6 mm -67.29 -35.16 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.659 0.663 . . . . 0.0 111.673 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -57.7 -57.92 10.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.22 1.408 . . . . 0.0 111.41 168.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.0 -32.33 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.435 1.016 . . . . 0.0 111.627 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -63.07 -56.15 19.37 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.459 -1.4 . . . . 0.0 112.196 171.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -58.62 -42.36 88.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.983 0.81 . . . . 0.0 111.962 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -53.85 -55.24 28.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.219 1.407 . . . . 0.0 111.055 171.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -73.98 10.9 1.02 Allowed 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.74 -61.03 1.45 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.577 1.951 . . . . 0.0 110.141 159.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -45.31 89.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.952 1.301 . . . . 0.0 112.744 -178.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 123.346 0.658 . . . . 0.0 112.578 174.878 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 122.387 1.089 . . . . 0.0 112.666 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -72.62 147.19 46.04 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.089 -1.007 . . . . 0.0 111.282 163.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -57.01 -36.87 70.93 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.61 -9.06 23.67 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.21 -46.12 6.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.405 1.882 . . . . 0.0 111.656 162.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mm -52.68 -43.25 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.171 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -60.25 -36.81 78.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.69 1.196 . . . . 0.0 113.276 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -48.15 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.16 0.891 . . . . 0.0 110.003 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.02 -46.19 90.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.599 1.159 . . . . 0.0 111.839 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.58 -41.67 97.74 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.697 1.199 . . . . 0.0 113.318 171.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.8 -42.28 79.25 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.845 1.657 . . . . 0.0 113.347 172.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.13 -50.22 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.411 1.005 . . . . 0.0 111.006 172.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -57.79 -33.93 69.07 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.798 1.639 . . . . 0.0 113.912 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -55.6 -52.45 63.75 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.213 2.205 . . . . 0.0 110.713 173.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.6 t -72.02 -42.28 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.474 1.51 . . . . 0.0 112.151 178.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -146.16 110.96 5.22 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.688 1.195 . . . . 0.0 112.887 -176.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 82.6 m -57.49 -24.66 57.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.333 1.453 . . . . 0.0 114.779 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -134.5 92.05 20.92 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.933 1.293 . . . . 0.0 112.237 -174.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -70.16 178.07 5.21 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.587 2.858 . . . . 0.0 113.471 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.4 -178.69 21.27 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 126.177 1.846 . . . . 0.0 112.628 169.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.32 -51.68 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.711 0.804 . . . . 0.0 111.414 -173.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -29.89 71.06 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.592 1.157 . . . . 0.0 112.305 -176.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.7 mt -71.74 -43.81 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.751 0.82 . . . . 0.0 109.555 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.21 -43.94 96.72 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.605 -0.684 . . . . 0.0 111.952 172.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.23 -35.87 80.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.654 1.181 . . . . 0.0 113.901 174.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -61.98 -47.3 85.42 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.117 1.326 . . . . 0.0 111.728 169.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.22 -48.44 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.669 0.787 . . . . 0.0 111.243 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.82 -56.03 21.25 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.451 1.1 . . . . 0.0 111.734 172.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -53.76 -23.73 12.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.203 1.801 . . . . 0.0 113.623 176.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -107.69 -2.7 19.88 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.976 1.71 . . . . 0.0 115.289 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.1 mt -134.5 -13.52 2.3 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -173.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.1 29.22 4.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.505 1.922 . . . . 0.0 114.853 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.3 mt -95.9 166.84 11.59 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.597 1.559 . . . . 0.0 110.985 160.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.07 153.47 21.24 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.428 1.108 . . . . 0.0 112.877 159.518 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 tt -51.03 -39.1 55.08 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.237 1.415 . . . . 0.0 113.462 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.03 -41.08 77.95 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.538 1.517 . . . . 0.0 112.834 175.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.99 -30.03 61.06 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.773 -1.204 . . . . 0.0 111.667 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 36.5 mt -73.88 -39.35 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.513 0.725 . . . . 0.0 111.588 169.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -51.68 -56.82 11.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.816 1.247 . . . . 0.0 111.292 167.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.6 mt -58.61 -34.72 52.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.709 0.804 . . . . 0.0 112.056 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.41 ' CZ2' ' HG3' ' A' ' 52' ' ' ARG . 79.1 t90 -61.92 -57.68 10.83 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.366 1.439 . . . . 0.0 110.953 171.411 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -58.68 -42.81 89.39 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -55.26 -53.06 60.87 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.338 1.055 . . . . 0.0 111.626 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -61.97 -48.38 80.63 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.949 1.25 . . . . 0.0 111.689 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG3' ' CZ2' ' A' ' 48' ' ' TRP . 2.8 mmt85 -65.68 -35.38 80.61 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.206 -0.934 . . . . 0.0 113.309 -177.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -43.24 67.4 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.106 1.321 . . . . 0.0 111.753 170.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 179.781 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 121.053 0.454 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.6 t -73.46 145.92 45.36 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.555 1.142 . . . . 0.0 111.504 168.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -55.82 -37.39 68.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.567 1.076 . . . . 0.0 113.717 -172.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -27.98 65.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 120.447 1.476 . . . . 0.0 112.719 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -82.22 -49.8 9.71 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.819 1.247 . . . . 0.0 111.041 169.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.4 mm -49.93 -46.56 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 118.064 -0.97 . . . . 0.0 112.447 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.56 -27.88 66.63 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.579 1.081 . . . . 0.0 113.147 -177.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.58 -50.89 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.8 1.182 . . . . 0.0 110.364 171.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.5 -43.75 93.13 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -56.67 -41.35 77.12 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.394 1.452 . . . . 0.0 111.671 170.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -58.12 -38.34 76.31 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.452 1.024 . . . . 0.0 113.661 172.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.96 -45.38 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.177 0.899 . . . . 0.0 111.356 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -59.12 -30.1 67.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.502 1.121 . . . . 0.0 113.953 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.7 mtp85 -57.04 -54.94 41.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.543 1.137 . . . . 0.0 112.205 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.5 m -79.5 -31.62 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -131.62 85.54 2.26 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.335 2.254 . . . . 0.0 111.229 -176.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -60.0 -30.72 69.32 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -129.63 102.83 17.88 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 126.591 1.957 . . . . 0.0 108.106 164.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -78.96 -175.93 3.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.914 3.076 . . . . 0.0 112.917 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.9 167.68 18.65 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 126.111 1.815 . . . . 0.0 113.201 167.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.4 mm -64.82 -35.52 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.498 1.119 . . . . 0.0 112.568 -171.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -64.73 -32.32 73.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.139 0.975 . . . . 0.0 112.881 176.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 mm -71.72 -37.48 62.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.863 0.865 . . . . 0.0 110.563 172.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 89.9 mt -67.14 -47.68 70.36 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.75 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.63 -53.65 44.13 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 120.02 1.282 . . . . 0.0 113.399 167.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.95 -42.88 80.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.894 1.679 . . . . 0.0 112.61 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.71 -44.97 95.95 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.114 -0.991 . . . . 0.0 112.689 172.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.44 -58.67 6.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.318 1.047 . . . . 0.0 111.395 173.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -53.9 -44.18 70.3 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.11 1.364 . . . . 0.0 112.928 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -86.05 -6.58 59.0 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.2 mt -121.93 2.95 9.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.045 1.338 . . . . 0.0 113.45 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 t30 61.0 24.38 14.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.049 2.139 . . . . 0.0 114.039 -177.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.7 mt -95.85 173.09 7.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.345 2.258 . . . . 0.0 109.868 174.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -111.06 162.48 14.84 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.284 1.033 . . . . 0.0 113.337 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.6 tp -48.06 -48.07 33.47 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.504 1.522 . . . . 0.0 112.522 -176.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -60.49 -39.72 88.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.379 1.072 . . . . 0.0 112.319 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -61.93 -40.68 96.33 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.885 1.22 . . . . 0.0 111.102 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -40.41 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 118.693 0.679 . . . . 0.0 111.23 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.83 -55.62 24.94 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.268 1.027 . . . . 0.0 112.23 169.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.81 -39.25 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.411 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -60.66 -50.51 73.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.824 1.647 . . . . 0.0 111.797 175.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -65.65 -41.34 92.68 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.942 0.792 . . . . 0.0 111.769 178.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -60.4 -40.13 89.84 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.955 1.252 . . . . 0.0 111.997 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.84 -52.01 66.79 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.799 1.181 . . . . 0.0 111.702 169.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -44.86 94.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -35.11 73.02 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.784 -1.198 . . . . 0.0 111.709 175.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.545 0 CA-C-N 119.704 1.138 . . . . 0.0 111.92 168.612 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 . . . . . 0 CA--C 1.546 0.797 0 CA-C-O 120.79 0.329 . . . . 0.0 111.474 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.6 t -73.16 150.88 41.8 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.701 0.8 . . . . 0.0 111.197 155.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.31 -33.27 74.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -167.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.91 -14.89 62.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.581 1.537 . . . . 0.0 113.198 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -78.39 -50.05 12.43 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.908 -1.12 . . . . 0.0 110.446 162.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.414 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 19.3 mm -48.34 -50.07 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.996 0.918 . . . . 0.0 112.051 175.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -60.6 -25.4 66.21 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.6 t -69.1 -43.42 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 120.078 1.308 . . . . 0.0 110.662 172.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 mp -65.82 -46.58 78.08 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.431 174.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -52.9 -47.2 68.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.716 1.143 . . . . 0.0 113.482 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -64.62 -27.2 68.77 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.4 t -71.99 -44.42 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.263 0.938 . . . . 0.0 111.508 164.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -56.42 -37.11 69.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.33 1.452 . . . . 0.0 113.353 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -69.91 -0.06 6.72 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.2 t -119.05 -37.29 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.069 1.748 . . . . 0.0 111.304 173.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -130.7 88.52 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.298 2.239 . . . . 0.0 110.163 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.73 -33.1 75.1 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.94 0.896 . . . . 0.0 112.77 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -122.78 87.97 50.18 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.901 1.68 . . . . 0.0 108.956 165.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -61.58 162.21 21.93 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.699 2.266 . . . . 0.0 114.538 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.73 164.08 44.64 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.017 0.818 . . . . 0.0 112.4 162.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.95 -39.1 70.23 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.817 0 C-N-CA 124.73 1.212 . . . . 0.0 111.103 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.31 -29.38 64.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.43 1.892 . . . . 0.0 112.972 -176.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.3 mt -69.58 -45.32 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 123.669 0.788 . . . . 0.0 109.168 170.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 14.9 mt -64.0 -43.37 95.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.553 0.741 . . . . 0.0 111.134 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.21 -35.99 80.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.446 1.498 . . . . 0.0 114.244 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.32 -44.97 93.42 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.706 -1.246 . . . . 0.0 112.05 168.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.63 -47.84 83.02 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.735 0.698 . . . . 0.0 111.912 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.82 -57.81 7.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 126.019 1.727 . . . . 0.0 111.189 174.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -57.3 -44.83 84.43 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.529 0.731 . . . . 0.0 112.587 177.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -75.12 -15.85 60.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.572 1.549 . . . . 0.0 114.656 -177.039 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 88.8 mt -122.77 -2.82 8.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.671 1.189 . . . . 0.0 114.199 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 55.87 56.28 6.19 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.741 2.016 . . . . 0.0 112.565 -174.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 79.9 mt -131.05 156.45 45.16 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.442 2.297 . . . . 0.0 108.691 176.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -85.37 154.19 22.03 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.819 0.736 . . . . 0.0 112.574 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.35 -47.65 6.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.493 1.917 . . . . 0.0 112.658 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.1 -34.73 78.71 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -64.28 -39.22 93.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.678 2.035 . . . . 0.0 111.347 173.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -44.92 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.295 -0.86 . . . . 0.0 111.486 174.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.28 -54.26 47.5 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.579 1.081 . . . . 0.0 111.396 172.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -56.38 -42.33 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 O-C-N 120.559 -1.338 . . . . 0.0 110.739 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.421 ' CE2' ' HD2' ' A' ' 52' ' ' ARG . 81.1 t90 -57.08 -55.84 29.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 120.432 1.469 . . . . 0.0 112.492 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -61.73 -48.03 82.56 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.82 0.848 . . . . 0.0 112.606 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -59.0 -40.93 86.4 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 120.18 1.355 . . . . 0.0 111.884 174.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -62.59 -38.02 88.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.116 1.326 . . . . 0.0 111.605 172.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HD2' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -63.42 -52.71 60.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.053 0.941 . . . . 0.0 112.744 174.285 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -36.58 84.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.344 1.058 . . . . 0.0 111.71 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 118.587 0.63 . . . . 0.0 111.299 164.427 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 . . . . . 0 CA--C 1.539 0.558 0 CA-C-O 122.144 0.973 . . . . 0.0 113.21 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.6 p -79.52 151.31 30.82 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.383 2.273 . . . . 0.0 111.285 171.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -56.75 -45.24 82.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -167.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.24 -21.38 63.82 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 121.578 1.99 . . . . 0.0 113.633 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -85.12 -38.59 18.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.794 1.238 . . . . 0.0 112.133 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.432 HD12 ' HE1' ' A' ' 48' ' ' TRP . 37.7 mm -57.7 -50.95 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.748 0.819 . . . . 0.0 111.392 171.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -66.05 -19.05 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -176.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 87.7 t -78.21 -42.77 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 120.384 -1.447 . . . . 0.0 110.653 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 71.8 mt -67.96 -48.91 64.55 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.488 1.115 . . . . 0.0 112.337 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -55.9 -40.52 73.17 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.768 1.227 . . . . 0.0 112.074 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -63.22 -25.35 68.29 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 174.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.59 -45.28 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.922 1.237 . . . . 0.0 111.215 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -53.9 -41.97 68.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.624 1.102 . . . . 0.0 112.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -6.36 23.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 175.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 61.0 t -110.58 -38.16 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.739 2.016 . . . . 0.0 111.303 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -141.36 97.41 3.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.107 2.163 . . . . 0.0 109.307 172.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 16.6 p -55.48 -33.21 63.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.936 0.894 . . . . 0.0 112.755 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.96 103.65 39.57 Favored Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 125.66 1.584 . . . . 0.0 109.39 161.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.64 179.93 5.13 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 124.201 3.267 . . . . 0.0 112.791 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.68 165.14 41.96 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.586 -0.696 . . . . 0.0 111.633 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -68.13 -36.36 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.595 1.198 . . . . 0.0 110.659 177.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.99 -36.32 74.71 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 170.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -73.47 -38.72 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.65 0.659 . . . . 0.0 110.378 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.17 -46.73 85.75 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.291 -0.88 . . . . 0.0 111.867 171.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.09 -51.12 67.39 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.749 1.619 . . . . 0.0 112.833 168.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -61.15 -41.62 97.08 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.412 1.005 . . . . 0.0 112.906 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -62.89 -45.83 90.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.572 0.749 . . . . 0.0 111.537 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.86 -53.07 62.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.062 0.945 . . . . 0.0 110.865 175.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -53.49 -40.45 65.35 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.822 1.649 . . . . 0.0 113.278 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.76 -12.74 18.1 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -174.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.1 mt -99.69 -4.84 29.92 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.37 1.068 . . . . 0.0 112.634 172.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.62 55.83 6.07 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.023 1.329 . . . . 0.0 110.819 -172.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.9 mt -126.11 177.8 6.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.981 2.112 . . . . 0.0 109.333 171.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 2.9 pm0 -104.1 162.06 13.48 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.865 -1.147 . . . . 0.0 112.655 161.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.81 -50.37 7.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.861 2.064 . . . . 0.0 112.0 173.117 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -58.64 -47.63 83.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.804 1.641 . . . . 0.0 114.126 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.416 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 47.2 mtt180 -63.94 -36.8 85.16 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 120.802 -1.186 . . . . 0.0 111.587 179.108 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.34 -42.09 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 118.512 -0.756 . . . . 0.0 112.313 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -52.13 -52.11 53.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.505 1.048 . . . . 0.0 111.434 169.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -59.1 -43.59 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 117.655 -1.164 . . . . 0.0 110.714 175.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TRP . . . . . 0.432 ' HE1' HD12 ' A' ' 13' ' ' ILE . 76.1 t90 -57.7 -55.1 39.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.959 1.709 . . . . 0.0 112.48 173.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -59.06 -46.57 87.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.342 0.973 . . . . 0.0 111.918 -177.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -65.04 -42.11 94.58 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.444 -0.785 . . . . 0.0 112.149 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -61.21 -38.33 86.22 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.391 1.451 . . . . 0.0 112.227 171.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.407 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -58.8 -58.3 9.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.596 1.158 . . . . 0.0 112.929 173.493 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -41.33 84.16 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 119.749 1.159 . . . . 0.0 111.738 177.045 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 172.398 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 120.991 0.424 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.0 t -62.65 144.39 56.32 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 121.338 -0.851 . . . . 0.0 109.938 158.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -56.05 -34.47 65.93 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.732 1.213 . . . . 0.0 112.909 176.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -70.72 -1.31 11.01 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 126.177 1.791 . . . . 0.0 113.991 173.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -104.25 -48.88 3.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.613 1.565 . . . . 0.0 110.116 159.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.5 mm -46.52 -46.06 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 124.627 1.171 . . . . 0.0 112.571 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -53.13 -38.08 62.36 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.3 t -66.22 -49.09 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 120.357 1.435 . . . . 0.0 109.985 176.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.24 -45.45 93.2 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.14 0.576 . . . . 0.0 112.55 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -61.16 -45.08 96.11 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 120.83 -1.169 . . . . 0.0 114.087 172.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -64.5 -25.82 68.16 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 120.65 1.568 . . . . 0.0 113.443 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.6 t -70.34 -53.56 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 120.254 1.388 . . . . 0.0 110.841 165.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -54.83 -30.46 57.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.91 1.284 . . . . 0.0 113.604 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -62.05 -23.12 66.29 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 128.325 2.65 . . . . 0.0 114.389 173.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.9 t -119.53 -30.26 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.91 1.684 . . . . 0.0 112.104 -173.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -142.77 96.99 3.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.317 1.447 . . . . 0.0 110.27 165.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -70.64 -8.28 50.58 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -145.77 76.2 12.88 Favored Pre-proline 0 CA--C 1.548 0.882 0 CA-C-N 119.334 0.97 . . . . 0.0 111.29 174.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -79.35 -173.38 1.85 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.108 3.205 . . . . 0.0 114.006 -170.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -94.89 173.33 31.85 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.46 1.505 . . . . 0.0 113.74 174.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.56 -41.37 92.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 C-N-CA 123.806 0.842 . . . . 0.0 111.988 -175.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.43 -36.95 72.04 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.972 0.909 . . . . 0.0 112.912 176.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.426 ' N ' HD12 ' A' ' 30' ' ' ILE . 1.7 mp -68.17 -42.15 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.106 0.866 . . . . 0.0 110.072 174.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 67.4 mt -62.55 -46.29 89.04 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 118.869 -0.586 . . . . 0.0 112.214 173.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -62.88 -43.8 97.82 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.776 1.631 . . . . 0.0 113.964 175.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.73 -35.54 81.41 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.275 1.398 . . . . 0.0 112.003 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -66.11 -50.4 64.16 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.271 -0.893 . . . . 0.0 111.89 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.45 -43.37 71.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.382 1.473 . . . . 0.0 112.252 177.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -56.29 -69.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.752 1.221 . . . . 0.0 112.016 167.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -69.08 -15.15 63.38 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -168.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.0 mt -120.71 3.48 10.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.976 1.311 . . . . 0.0 114.376 -176.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.77 71.92 0.48 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.993 2.117 . . . . 0.0 113.716 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.8 mt -141.38 165.7 26.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.95 2.1 . . . . 0.0 109.643 170.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.24 147.11 31.36 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.888 -1.133 . . . . 0.0 112.077 158.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -49.99 -35.54 24.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.989 0.916 . . . . 0.0 113.199 172.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.76 -42.2 75.11 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 112.381 174.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -74.97 -32.12 61.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.173 -0.955 . . . . 0.0 113.319 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 4.1 mm -66.72 -39.86 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.543 1.065 . . . . 0.0 111.298 168.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.81 -58.67 7.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.958 1.303 . . . . 0.0 110.716 171.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.5 mt -54.1 -38.51 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.524 1.056 . . . . 0.0 111.469 175.317 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.66 -59.45 5.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 120.193 1.36 . . . . 0.0 112.956 172.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -58.96 -43.39 91.3 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.139 0.882 . . . . 0.0 111.959 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -64.43 -42.87 95.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 111.644 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -62.54 -38.43 89.97 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.645 1.566 . . . . 0.0 111.713 172.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -61.54 2.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.544 1.138 . . . . 0.0 112.328 173.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -37.41 86.4 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.491 -0.766 . . . . 0.0 112.02 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.705 0 CA-C-N 119.324 0.965 . . . . 0.0 112.852 172.068 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.913 0 CA-C-O 118.494 -1.17 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 12.37 66.58 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.937 3.695 . . . . 0.0 116.77 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 64.6 mtt-85 -71.66 146.82 91.57 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 123.907 0.883 . . . . 0.0 112.161 -172.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.63 179.14 4.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.448 2.765 . . . . 0.0 111.709 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.93 97.39 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.744 0.818 . . . . 0.0 109.669 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.8 m -75.24 145.08 42.24 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.081 1.752 . . . . 0.0 109.993 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -130.43 164.42 24.79 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.545 1.138 . . . . 0.0 111.259 173.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -131.94 -172.01 2.77 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.984 1.714 . . . . 0.0 111.233 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.0 t -65.87 145.76 55.55 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.153 0.581 . . . . 0.0 110.268 155.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.07 -19.71 63.21 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.089 -1.007 . . . . 0.0 113.121 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.83 -14.22 62.89 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.783 1.233 . . . . 0.0 113.432 170.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -98.16 -43.14 7.12 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.78 2.032 . . . . 0.0 110.13 172.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.3 -46.49 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.093 0.957 . . . . 0.0 110.913 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.34 69.2 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.91 -46.5 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 120.022 1.283 . . . . 0.0 109.638 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.32 -45.32 91.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.458 1.103 . . . . 0.0 112.206 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -48.62 -58.74 4.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.674 1.59 . . . . 0.0 113.009 166.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -68.06 -19.26 64.86 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -174.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 71.8 t -73.75 -51.42 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.896 1.278 . . . . 0.0 111.684 162.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -53.84 -30.2 44.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.881 1.673 . . . . 0.0 113.396 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -50.18 -52.94 31.35 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.438 1.017 . . . . 0.0 112.344 167.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.69 -49.45 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 127.982 2.513 . . . . 0.0 111.148 -173.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -131.63 96.52 3.98 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 112.294 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.6 -12.19 14.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.01 -1.056 . . . . 0.0 113.773 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -146.76 103.95 3.92 Favored Pre-proline 0 CA--C 1.547 0.839 0 O-C-N 120.324 -1.485 . . . . 0.0 110.82 160.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -75.77 176.15 10.37 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.674 2.916 . . . . 0.0 113.478 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -100.78 176.93 27.68 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.65 1.595 . . . . 0.0 113.364 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.8 mm -62.5 -39.93 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -65.7 -32.85 74.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.115 0.87 . . . . 0.0 113.045 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.5 mm -71.74 -38.58 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 123.696 0.798 . . . . 0.0 110.679 172.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.31 -47.86 77.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.726 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -41.41 94.41 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.517 1.053 . . . . 0.0 113.478 170.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -56.61 -50.44 71.99 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.285 -1.509 . . . . 0.0 112.072 172.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.6 mt -61.54 -42.2 98.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.357 0.663 . . . . 0.0 112.25 174.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -53.5 57.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.674 1.19 . . . . 0.0 112.214 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -65.15 -29.85 70.72 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -81.74 -56.45 3.99 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.745 1.218 . . . . 0.0 113.747 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 89.6 mt -74.08 -10.13 59.32 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.341 1.456 . . . . 0.0 113.781 -171.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 48.4 70.27 0.47 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.409 1.884 . . . . 0.0 111.476 -159.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.9 mt -135.24 158.5 44.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.488 1.915 . . . . 0.0 108.573 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -88.02 145.68 25.87 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.266 1.426 . . . . 0.0 110.403 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.3 tt -48.49 -41.29 29.42 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -54.18 -49.22 69.81 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.183 1.393 . . . . 0.0 112.749 175.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -59.9 -40.46 88.86 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.895 -1.128 . . . . 0.0 111.969 175.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -74.95 -34.08 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 118.745 0.702 . . . . 0.0 112.446 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -57.45 -52.46 65.27 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.424 1.011 . . . . 0.0 111.786 167.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -57.8 -37.92 62.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.255 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -61.35 -58.72 7.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 120.83 1.65 . . . . 0.0 112.361 172.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -57.94 -42.06 84.1 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -70.53 -38.84 74.29 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 120.623 -1.298 . . . . 0.0 113.466 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -62.73 -32.77 73.95 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 121.02 1.736 . . . . 0.0 111.985 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.408 HH11 ' CG ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -57.37 -58.81 6.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.582 1.153 . . . . 0.0 113.074 172.907 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 -56.25 -50.09 72.33 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.363 0.665 . . . . 0.0 111.846 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.12 -47.6 65.23 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.807 1.039 . . . . 0.0 113.807 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.54 -48.47 81.62 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.189 -0.944 . . . . 0.0 112.323 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.5 tp -59.35 -37.12 77.04 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.545 1.138 . . . . 0.0 113.076 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -67.45 -43.95 79.84 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.692 0.797 . . . . 0.0 112.484 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 71.82 -41.36 0.5 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 128.674 2.79 . . . . 0.0 114.997 170.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 p -136.07 163.04 31.25 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.609 1.964 . . . . 0.0 111.0 165.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.1 m80 64.77 173.03 0.2 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 128.138 2.575 . . . . 0.0 114.811 -177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -158.26 150.21 21.66 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.834 2.454 . . . . 0.0 110.706 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -50.72 -67.0 0.29 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.442 1.497 . . . . 0.0 113.213 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.9 t -73.49 25.71 0.07 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.48 1.512 . . . . 0.0 113.338 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -140.9 155.51 46.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.877 1.671 . . . . 0.0 111.306 -171.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -153.41 -54.44 0.11 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.288 1.835 . . . . 0.0 109.35 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.4 tp 58.73 -49.06 0.06 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 129.108 2.963 . . . . 0.0 114.356 -166.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 C--O 1.249 1.072 0 C-N-CA 127.75 2.42 . . . . 0.0 111.895 -177.117 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 CA-C-O 119.091 -0.838 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -63.19 89.97 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.572 2.349 . . . . 0.0 111.501 178.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 33.8 ttt85 -153.54 135.53 9.08 Favored Pre-proline 0 N--CA 1.475 0.781 0 C-N-CA 124.609 1.163 . . . . 0.0 111.246 -166.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -77.3 54.28 4.61 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 124.05 3.167 . . . . 0.0 114.271 -176.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.2 ttt85 -148.87 129.2 13.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.512 1.525 . . . . 0.0 110.415 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -112.12 -15.99 13.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.682 1.593 . . . . 0.0 112.28 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.05 93.83 0.21 Allowed 'General case' 0 CA--C 1.547 0.833 0 O-C-N 119.921 -1.737 . . . . 0.0 111.915 165.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -66.38 -167.38 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 129.289 3.036 . . . . 0.0 115.238 -176.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.2 t -67.86 140.79 56.56 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.918 1.687 . . . . 0.0 110.488 162.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.54 -32.84 65.52 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -61.96 -33.69 74.75 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.0 1.273 . . . . 0.0 113.461 175.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.09 -40.63 45.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.726 1.21 . . . . 0.0 111.403 174.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.61 -56.21 16.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.638 0 CA-C-N 118.518 0.599 . . . . 0.0 110.616 173.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.7 -10.64 57.56 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.6 t -82.25 -52.23 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.156 0.983 . . . . 0.0 110.838 161.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -57.62 -48.1 80.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.33 1.052 . . . . 0.0 112.797 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -58.31 -38.82 77.84 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.14 1.376 . . . . 0.0 112.444 171.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -60.47 -32.53 71.49 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.9 t -73.05 -50.96 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.266 0.939 . . . . 0.0 110.559 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -54.87 -28.7 52.12 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.825 1.25 . . . . 0.0 114.01 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -56.13 -63.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.328 1.851 . . . . 0.0 112.374 165.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.6 -35.14 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -141.72 106.24 4.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.22 1.408 . . . . 0.0 111.497 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -61.91 -26.25 68.06 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.898 -1.126 . . . . 0.0 113.344 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -121.77 96.4 47.18 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 127.343 2.257 . . . . 0.0 109.615 166.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -62.52 166.28 13.73 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.32 2.013 . . . . 0.0 111.78 167.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.55 165.27 54.37 Favored Glycine 0 CA--C 1.534 1.242 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 163.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.0 mm -62.07 -32.44 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 O-C-N 121.705 -0.88 . . . . 0.0 111.281 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.58 -29.25 69.83 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.873 1.669 . . . . 0.0 112.655 177.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 52.6 mt -80.5 -38.75 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 123.891 0.876 . . . . 0.0 109.655 174.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.3 mt -63.0 -43.04 99.87 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.487 -0.758 . . . . 0.0 111.649 171.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -55.64 32.28 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.497 -1.24 . . . . 0.0 112.728 164.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -55.67 -39.06 70.44 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.448 1.931 . . . . 0.0 112.889 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.84 -53.79 53.78 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.089 0.956 . . . . 0.0 111.452 170.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.07 -55.85 18.08 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.862 1.21 . . . . 0.0 112.186 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.8 mm-40 -54.91 -40.28 69.68 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.401 1.88 . . . . 0.0 111.808 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -27.13 30.91 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 178.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.9 -19.64 15.18 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 120.026 1.284 . . . . 0.0 114.048 -171.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 62.34 32.42 16.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.194 1.797 . . . . 0.0 113.764 -170.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.2 mt -90.96 171.54 9.21 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.803 150.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.04 163.67 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.333 1.063 . . . . 0.0 112.926 161.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.87 -51.74 4.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.711 2.004 . . . . 0.0 112.143 172.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -53.43 -55.36 25.84 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.202 1.801 . . . . 0.0 114.062 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.7 mtt85 -65.49 -34.41 78.22 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.202 -0.936 . . . . 0.0 111.504 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.2 mt -71.22 -41.19 74.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.033 0.833 . . . . 0.0 112.032 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -57.38 -53.44 58.08 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.155 1.343 . . . . 0.0 110.922 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.3 mt -56.06 -43.14 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.984 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -56.42 -56.56 19.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.349 1.431 . . . . 0.0 112.61 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -56.86 -48.61 77.71 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.596 0.759 . . . . 0.0 112.336 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -63.08 -44.23 96.33 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.018 -0.992 . . . . 0.0 111.181 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -62.85 -34.54 77.58 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.28 1.4 . . . . 0.0 112.78 174.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -65.45 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.837 1.255 . . . . 0.0 112.467 170.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -41.31 82.43 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 119.481 1.037 . . . . 0.0 113.298 177.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.55 -9.61 14.09 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -130.23 7.72 5.04 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.9 tp -51.07 -57.54 8.4 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.534 1.516 . . . . 0.0 111.867 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.82 14.04 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 172.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.5 ttt85 -139.32 17.94 2.58 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.15 1.78 . . . . 0.0 113.71 166.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -96.72 72.5 2.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.583 -1.323 . . . . 0.0 112.044 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -70.95 50.52 0.14 Allowed 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 126.93 2.092 . . . . 0.0 114.982 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -134.59 2.04 3.16 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 128.63 2.772 . . . . 0.0 112.466 172.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.545 ' HG2' ' H ' ' A' ' 64' ' ' GLN . 28.4 tt0 -72.43 159.95 33.13 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.306 -0.871 . . . . 0.0 110.712 163.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.4 m -146.67 35.49 0.95 Allowed 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.641 -1.287 . . . . 0.0 111.155 170.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.545 ' H ' ' HG2' ' A' ' 62' ' ' GLU . 15.3 tp60 -78.7 -66.85 0.81 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.907 1.283 . . . . 0.0 111.001 -177.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -148.22 -81.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.452 0.701 . . . . 0.0 112.128 173.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 tp -162.29 160.75 27.14 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.082 2.553 . . . . 0.0 108.161 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 8.3 ttt . . . . . 0 C--O 1.248 1.01 0 CA-C-N 119.202 0.91 . . . . 0.0 111.747 169.753 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.883 0 N-CA-C 111.066 -0.813 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -133.73 -176.57 4.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.073 2.149 . . . . 0.0 112.519 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 8.83 75.49 0.06 OUTLIER Pre-proline 0 N--CA 1.491 1.62 0 C-N-CA 129.985 3.314 . . . . 0.0 115.559 -173.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -78.5 49.2 2.98 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 124.045 3.163 . . . . 0.0 113.914 -173.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -61.12 103.98 0.33 Allowed 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.646 -1.284 . . . . 0.0 110.185 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.8 m -71.27 135.58 47.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.625 -0.672 . . . . 0.0 110.989 -173.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.16 122.55 25.5 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.053 1.341 . . . . 0.0 110.5 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -94.66 -169.22 1.98 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.98 1.712 . . . . 0.0 112.398 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.0 t -76.31 153.65 35.71 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.188 -0.945 . . . . 0.0 111.657 161.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -53.97 -40.18 66.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 123.852 0.861 . . . . 0.0 112.787 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -63.9 -9.58 16.13 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -101.62 -38.25 8.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.297 1.839 . . . . 0.0 111.807 168.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -55.47 -51.85 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.12 0.968 . . . . 0.0 110.873 172.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -60.48 -29.85 69.32 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -176.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 64.7 t -70.56 -46.66 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 119.28 0.946 . . . . 0.0 110.652 172.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.1 mt -64.19 -46.75 82.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.624 1.17 . . . . 0.0 111.544 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -51.94 -53.27 43.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.702 . . . . 0.0 112.309 165.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -55.41 -30.21 60.01 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 178.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 92.0 t -72.54 -55.16 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 119.609 1.095 . . . . 0.0 111.039 166.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -51.84 -32.02 30.17 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.517 1.527 . . . . 0.0 113.873 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -67.04 -22.91 65.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.418 2.687 . . . . 0.0 114.662 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 m -117.52 -35.75 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.015 1.726 . . . . 0.0 113.096 174.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -114.55 78.32 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.491 1.916 . . . . 0.0 109.379 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.4 m -55.99 -20.37 16.2 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.568 1.547 . . . . 0.0 114.833 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -143.81 98.29 5.29 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.228 1.011 . . . . 0.0 109.678 165.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.91 169.54 20.12 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.45 2.1 . . . . 0.0 111.516 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.49 167.11 33.6 Favored Glycine 0 CA--C 1.532 1.121 0 O-C-N 121.762 -0.586 . . . . 0.0 112.4 169.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.27 -29.96 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 117.944 -1.027 . . . . 0.0 111.993 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -40.04 86.07 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.703 1.592 . . . . 0.0 112.963 171.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mm -69.82 -38.57 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 118.722 0.692 . . . . 0.0 110.929 173.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 79.3 mt -66.57 -45.34 79.62 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.377 -0.827 . . . . 0.0 112.55 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -52.8 -58.21 7.62 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.858 2.063 . . . . 0.0 112.458 165.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.39 -36.4 82.18 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.844 1.202 . . . . 0.0 112.877 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.1 mt -60.42 -48.09 83.28 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.649 1.113 . . . . 0.0 111.938 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.09 -56.23 23.31 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.797 1.239 . . . . 0.0 110.341 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.76 -2.78 1.93 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.557 1.943 . . . . 0.0 115.44 176.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -128.9 -18.34 3.81 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 120.753 1.615 . . . . 0.0 114.885 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -97.41 1.88 49.77 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.05 2.14 . . . . 0.0 111.987 163.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.3 t30 43.57 60.18 2.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 128.485 2.714 . . . . 0.0 113.843 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -119.39 173.76 6.77 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.691 2.796 . . . . 0.0 108.097 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 4.9 pm0 -96.73 166.62 11.56 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 120.814 -1.179 . . . . 0.0 112.637 164.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.6 tp -52.37 -47.38 66.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.419 177.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -53.46 52.75 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.063 0.847 . . . . 0.0 112.184 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.408 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 53.7 mtt180 -65.52 -30.01 70.71 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.709 1.141 . . . . 0.0 112.354 -173.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.4 mt -78.42 -39.97 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.632 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -54.35 -53.6 51.74 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 120.659 1.572 . . . . 0.0 112.627 170.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.74 -36.16 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 117.304 -1.332 . . . . 0.0 110.81 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -58.93 -61.55 2.55 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.511 1.96 . . . . 0.0 111.77 169.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -55.48 -49.9 71.29 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.087 0.858 . . . . 0.0 112.183 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -60.84 -35.39 76.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.294 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -64.26 -51.96 61.01 Favored 'General case' 0 C--N 1.347 0.5 0 CA-C-N 120.81 1.641 . . . . 0.0 111.604 171.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -58.75 -47.27 85.24 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 120.582 1.537 . . . . 0.0 111.545 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -35.12 79.35 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.94 1.296 . . . . 0.0 113.113 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.66 -49.31 54.88 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.466 1.03 . . . . 0.0 113.479 167.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -54.88 -29.3 55.23 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.385 2.274 . . . . 0.0 112.217 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.48 -51.19 70.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.322 1.449 . . . . 0.0 112.12 170.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.3 -40.16 93.14 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 119.472 1.033 . . . . 0.0 111.871 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -79.79 55.56 2.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.065 1.346 . . . . 0.0 112.145 166.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.5 p -150.09 170.37 19.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.792 1.237 . . . . 0.0 111.035 163.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -143.62 82.08 1.72 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -174.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.25 163.77 32.06 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.258 1.423 . . . . 0.0 109.664 166.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -137.55 146.72 44.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.207 1.803 . . . . 0.0 109.272 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.1 m -109.07 139.0 44.54 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.965 0.906 . . . . 0.0 112.01 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -78.99 131.26 36.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.039 0.535 . . . . 0.0 111.52 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.54 170.59 10.34 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.994 1.718 . . . . 0.0 113.324 -175.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.434 ' HG ' ' H ' ' A' ' 67' ' ' MET . 6.2 tp -137.25 179.58 6.31 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.616 1.566 . . . . 0.0 111.703 -176.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.434 ' H ' ' HG ' ' A' ' 66' ' ' LEU . 90.2 mtp . . . . . 0 C--O 1.249 1.064 0 C-N-CA 125.711 1.605 . . . . 0.0 111.743 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.836 0 N-CA-C 109.189 -1.564 . . . . 0.0 109.189 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -136.38 104.76 5.71 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.196 1.398 . . . . 0.0 109.864 166.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -41.81 131.59 2.42 Favored Pre-proline 0 N--CA 1.483 1.221 0 C-N-CA 126.344 1.858 . . . . 0.0 115.247 -161.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.19 119.77 6.81 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.856 2.371 . . . . 0.0 111.002 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 66.86 126.95 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 128.282 2.633 . . . . 0.0 112.395 -171.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.8 m -56.18 -58.29 8.59 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.58 1.552 . . . . 0.0 113.966 -172.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.31 148.49 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 129.476 3.11 . . . . 0.0 116.629 -172.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -129.21 -169.48 2.1 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.21 2.604 . . . . 0.0 110.2 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.4 t -84.16 147.26 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.087 -1.008 . . . . 0.0 110.249 158.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -57.62 -32.25 67.04 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.67 1.123 . . . . 0.0 112.188 176.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.45 -31.5 62.0 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.461 1.504 . . . . 0.0 113.081 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -88.58 -41.51 12.63 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 126.175 1.79 . . . . 0.0 111.026 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.3 mm -51.99 -47.29 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.819 0.848 . . . . 0.0 110.849 171.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.75 -50.91 17.39 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.8 t -66.59 -41.33 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 O-C-N 121.37 -0.831 . . . . 0.0 111.002 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.07 -46.42 81.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.583 1.153 . . . . 0.0 112.361 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -66.01 -36.31 82.92 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.964 -1.085 . . . . 0.0 112.862 172.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -59.9 -32.45 70.76 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.99 -50.89 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.824 1.193 . . . . 0.0 111.358 168.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -53.3 -32.92 51.17 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.231 1.412 . . . . 0.0 113.5 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -60.03 -26.02 65.78 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.774 2.43 . . . . 0.0 114.064 173.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.7 t -108.09 -38.14 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 126.326 1.85 . . . . 0.0 111.884 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -127.53 85.21 2.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.481 1.513 . . . . 0.0 110.155 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -53.58 -33.02 53.34 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.518 1.527 . . . . 0.0 113.005 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -117.46 119.02 34.87 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 123.935 0.894 . . . . 0.0 109.426 154.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -75.74 172.01 17.1 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.392 2.728 . . . . 0.0 111.693 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.79 171.37 50.92 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 123.972 0.796 . . . . 0.0 112.221 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.8 mm -64.3 -48.56 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.736 -0.861 . . . . 0.0 110.307 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.58 -28.92 49.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.194 2.198 . . . . 0.0 113.878 173.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.7 mt -80.46 -34.8 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 123.727 0.811 . . . . 0.0 110.605 175.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -67.23 -45.59 76.32 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.868 0.867 . . . . 0.0 111.746 169.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.03 -54.99 36.02 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.093 1.757 . . . . 0.0 112.354 169.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -59.66 -43.59 93.88 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.282 0.946 . . . . 0.0 111.781 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.9 mt -62.41 -42.88 99.77 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 120.964 -1.085 . . . . 0.0 112.728 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.05 -58.63 7.57 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.225 0.921 . . . . 0.0 110.884 173.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -61.39 -32.86 72.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.8 1.24 . . . . 0.0 113.59 -176.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.7 tttp -90.46 -45.02 9.23 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.751 1.221 . . . . 0.0 113.524 -173.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.77 -12.0 60.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.325 1.05 . . . . 0.0 113.061 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 80.99 60.28 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.328 2.651 . . . . 0.0 110.488 171.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.3 mt -136.75 -164.48 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.785 2.834 . . . . 0.0 109.231 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.15 149.05 51.03 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.877 1.271 . . . . 0.0 110.691 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.56 -38.14 66.29 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.71 1.204 . . . . 0.0 113.452 -169.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -55.87 -42.01 75.24 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.598 1.09 . . . . 0.0 112.865 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -67.67 -37.62 82.61 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.114 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.4 mm -72.02 -38.59 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 118.606 0.639 . . . . 0.0 111.854 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.65 -57.5 12.13 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.17 1.388 . . . . 0.0 111.393 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.5 mt -57.38 -41.91 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.751 0.705 . . . . 0.0 110.826 175.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -59.59 -55.22 37.23 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.516 1.053 . . . . 0.0 112.858 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -62.75 -44.83 95.19 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.339 0.972 . . . . 0.0 111.135 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.79 -44.52 86.35 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.424 1.011 . . . . 0.0 111.59 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -60.34 -49.7 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.773 1.169 . . . . 0.0 112.194 173.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -58.07 9.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.136 0.974 . . . . 0.0 112.43 176.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -38.27 87.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.702 1.601 . . . . 0.0 111.867 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.46 -47.07 80.4 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.012 1.278 . . . . 0.0 112.165 171.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -86.57 -11.13 52.42 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -171.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.3 tp -31.61 -62.53 0.19 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 127.196 2.198 . . . . 0.0 113.84 -168.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -62.68 -33.49 75.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.9 51.12 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.135 1.334 . . . . 0.0 112.595 172.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t 48.7 -115.7 0.77 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.75 2.02 . . . . 0.0 112.215 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.1 t60 -152.77 -176.72 5.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.211 1.805 . . . . 0.0 110.694 160.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.66 78.88 0.29 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.364 1.065 . . . . 0.0 109.039 153.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -136.04 143.8 44.9 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.743 0.782 . . . . 0.0 112.284 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.1 p -151.3 54.1 0.86 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.382 1.473 . . . . 0.0 112.021 -162.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -144.94 76.98 1.51 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.001 1.32 . . . . 0.0 110.546 175.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -150.86 156.77 41.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.78 1.232 . . . . 0.0 111.077 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -83.28 74.74 10.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.099 0.96 . . . . 0.0 111.257 -177.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 45.2 ttp . . . . . 0 C--O 1.248 0.977 0 CA-C-O 116.523 -1.703 . . . . 0.0 111.948 156.407 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.042 0 CA-C-O 119.273 -0.737 . . . . 0.0 111.903 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 119.73 19.45 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.654 1 C-N-CA 133.552 4.741 . . . . 0.0 112.343 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -73.57 158.54 86.23 Favored Pre-proline 0 N--CA 1.479 0.999 0 C-N-CA 125.01 1.324 . . . . 0.0 112.034 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -79.31 47.0 2.36 Favored 'Trans proline' 0 CA--C 1.549 1.243 0 C-N-CA 123.946 3.097 . . . . 0.0 114.893 -173.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.1 ttt85 -142.88 88.4 2.05 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.29 1.836 . . . . 0.0 109.169 165.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.0 m -74.34 -23.19 59.0 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.537 0.735 . . . . 0.0 112.277 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.07 107.37 0.22 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.481 1.512 . . . . 0.0 114.173 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.1 -171.52 0.75 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.306 2.242 . . . . 0.0 113.224 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -66.46 147.05 53.84 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.725 0.81 . . . . 0.0 110.41 158.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -52.09 -34.99 46.47 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.788 0.835 . . . . 0.0 112.717 172.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.13 -11.48 60.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -89.71 -44.69 9.84 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.338 1.855 . . . . 0.0 110.407 166.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.8 mm -54.69 -42.35 60.73 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 C-N-CA 125.4 1.48 . . . . 0.0 110.765 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -50.42 -47.45 56.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 173.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -67.61 -43.07 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.653 1.115 . . . . 0.0 110.081 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.87 -43.38 88.52 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.263 1.025 . . . . 0.0 112.213 -179.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.448 ' CD ' HH12 ' A' ' 52' ' ' ARG . 24.2 mt-10 -63.45 -43.36 97.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.724 1.147 . . . . 0.0 113.006 170.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -59.4 -36.5 75.94 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.8 t -71.45 -45.55 68.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 120.227 1.376 . . . . 0.0 111.483 171.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -54.3 -34.34 60.74 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.078 0.951 . . . . 0.0 113.047 176.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -54.02 -39.23 65.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.738 2.015 . . . . 0.0 113.733 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.91 -45.98 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.594 1.558 . . . . 0.0 110.821 174.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -130.17 88.45 2.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.8 1.64 . . . . 0.0 111.498 -168.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.9 m -58.01 -21.49 45.15 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -153.24 88.37 3.77 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.275 1.83 . . . . 0.0 108.58 172.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.96 177.91 8.16 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.52 2.813 . . . . 0.0 112.78 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.07 164.84 54.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.657 0.646 . . . . 0.0 113.744 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 27.3 mm -62.07 -43.38 97.63 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 O-C-N 121.97 -0.724 . . . . 0.0 112.311 -171.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.42 -23.73 64.61 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.389 0.995 . . . . 0.0 113.175 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 22.8 mm -81.71 -40.61 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.674 1.59 . . . . 0.0 110.173 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.67 -49.82 71.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.07 0.948 . . . . 0.0 111.624 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.98 -39.24 85.02 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 169.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.04 -48.46 67.6 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 120.799 1.636 . . . . 0.0 112.702 170.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.2 mt -67.69 -40.08 84.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.83 0.852 . . . . 0.0 112.12 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.63 -55.92 21.66 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.608 1.163 . . . . 0.0 110.992 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -62.9 -51.74 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.753 -0.592 . . . . 0.0 111.954 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -72.43 -8.35 54.58 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.6 mt -120.87 4.63 10.49 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.026 1.33 . . . . 0.0 112.382 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.8 t30 37.23 75.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.425 2.69 . . . . 0.0 112.684 -165.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.5 mt -135.89 164.78 27.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.039 2.536 . . . . 0.0 107.79 169.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -87.91 155.24 19.95 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 120.704 -1.248 . . . . 0.0 112.184 166.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -45.01 -49.91 11.03 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.38 1.872 . . . . 0.0 111.646 175.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.08 -39.13 77.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.643 1.177 . . . . 0.0 113.839 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.95 -43.22 79.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.749 -1.22 . . . . 0.0 111.141 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.5 mm -66.14 -42.01 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.621 0.646 . . . . 0.0 111.026 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -56.5 -52.09 66.05 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.318 0.963 . . . . 0.0 112.123 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -59.25 -37.68 70.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.25 -0.906 . . . . 0.0 111.58 173.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -60.66 -59.93 4.6 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 120.514 1.506 . . . . 0.0 112.267 171.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -55.17 -47.42 75.19 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.975 0.51 . . . . 0.0 111.59 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -62.66 -39.45 93.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 116.831 -1.557 . . . . 0.0 112.856 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -60.65 -40.04 90.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 121.427 1.921 . . . . 0.0 111.443 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.448 HH12 ' CD ' ' A' ' 17' ' ' GLU . 12.4 mmt85 -66.22 -55.46 16.08 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER -69.04 -18.4 64.01 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 177.809 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.12 -60.66 2.2 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.745 1.157 . . . . 0.0 111.368 162.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -53.76 -41.93 67.69 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.309 0.958 . . . . 0.0 112.536 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 67.1 tp -39.82 -48.23 2.23 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.678 1.991 . . . . 0.0 112.996 175.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -133.18 60.95 1.69 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.843 1.257 . . . . 0.0 109.79 171.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.2 ttm-85 -63.8 142.91 58.23 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.884 -0.51 . . . . 0.0 110.62 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.0 t -62.81 130.9 46.92 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 161.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -81.34 41.29 0.6 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.349 1.46 . . . . 0.0 111.674 -175.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -85.02 173.36 10.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.986 2.514 . . . . 0.0 114.943 -164.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -108.11 163.63 12.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.302 1.841 . . . . 0.0 112.127 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.9 t -144.4 172.01 13.54 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.064 1.346 . . . . 0.0 109.759 154.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -114.41 123.71 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.542 1.537 . . . . 0.0 110.177 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -156.81 156.1 32.67 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.758 1.623 . . . . 0.0 109.228 173.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -141.06 174.24 10.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.303 1.441 . . . . 0.0 111.588 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 126.591 1.956 . . . . 0.0 108.837 164.693 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.681 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -75.5 93.07 2.94 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.56 -0.965 . . . . 0.0 113.061 -163.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -134.04 88.12 32.58 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 124.585 1.154 . . . . 0.0 113.165 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -61.35 155.25 53.12 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 121.861 1.707 . . . . 0.0 110.912 169.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.81 55.47 0.56 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 127.362 2.265 . . . . 0.0 113.537 -166.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.3 m -59.76 138.8 57.67 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.454 -0.779 . . . . 0.0 110.749 170.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.33 174.33 10.51 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.91 1.684 . . . . 0.0 110.003 167.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -136.34 -173.06 3.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.934 2.093 . . . . 0.0 110.601 -169.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.6 t -57.07 145.96 29.03 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.634 -0.667 . . . . 0.0 111.042 162.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -58.81 -24.08 61.36 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.38 -41.16 96.66 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.372 0.987 . . . . 0.0 113.398 169.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -79.92 -30.68 40.08 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.156 0.982 . . . . 0.0 111.816 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mm -62.36 -49.14 85.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.478 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.281 168.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.26 -31.06 71.58 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.296 1.407 . . . . 0.0 114.213 -176.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 75.4 t -66.12 -46.82 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.018 0.826 . . . . 0.0 110.758 170.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.4 -43.08 86.78 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.305 1.042 . . . . 0.0 112.654 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -52.99 -52.57 57.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.846 1.658 . . . . 0.0 112.135 164.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -54.43 -46.42 73.23 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.899 0.772 . . . . 0.0 112.405 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 75.7 t -58.77 -52.02 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.362 172.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -56.23 -41.36 75.56 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.681 1.582 . . . . 0.0 112.177 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -61.73 -25.47 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.119 1.767 . . . . 0.0 113.521 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.6 t -100.65 -28.33 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.942 1.697 . . . . 0.0 112.284 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -140.96 83.6 1.89 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.59 2.356 . . . . 0.0 111.147 -171.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.5 m -57.42 -25.19 59.21 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -135.24 96.81 13.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.642 1.577 . . . . 0.0 109.944 166.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.92 163.61 38.29 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.472 2.115 . . . . 0.0 111.447 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.87 169.26 50.15 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.064 0.84 . . . . 0.0 113.176 172.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 mm -61.77 -38.64 80.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.695 -0.885 . . . . 0.0 111.937 -176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -30.19 69.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.955 1.302 . . . . 0.0 112.252 177.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.0 mt -71.65 -41.31 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 119.3 0.955 . . . . 0.0 110.038 170.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.02 -46.66 88.76 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.667 -0.646 . . . . 0.0 111.845 172.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -63.21 -37.9 89.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.686 1.595 . . . . 0.0 114.294 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -68.41 -38.81 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.016 -1.052 . . . . 0.0 111.924 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.14 -45.96 86.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.445 0.698 . . . . 0.0 111.329 170.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.87 -60.14 3.52 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.867 1.267 . . . . 0.0 111.388 174.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.4 tp60 -63.21 -27.02 69.07 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -107.48 -4.62 18.27 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -108.54 -6.53 16.05 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.77 2.028 . . . . 0.0 112.13 165.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.75 60.96 3.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.665 1.586 . . . . 0.0 111.388 -170.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.4 mt -131.53 155.24 47.79 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 127.372 2.269 . . . . 0.0 109.197 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.529 ' CD ' ' HE ' ' A' ' 44' ' ' ARG . 4.8 pm0 -76.36 142.89 41.04 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 122.784 1.278 . . . . 0.0 111.066 160.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.7 tt -50.58 -35.71 31.36 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 124.958 1.303 . . . . 0.0 111.594 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.33 -51.29 46.75 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.253 1.821 . . . . 0.0 113.229 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.529 ' HE ' ' CD ' ' A' ' 41' ' ' GLU . 85.9 mtt-85 -63.67 -41.55 98.16 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.559 -0.713 . . . . 0.0 111.395 176.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 48.5 mt -70.38 -37.2 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -61.35 -51.52 68.5 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.014 1.326 . . . . 0.0 110.533 172.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.4 mt -57.78 -42.49 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 118.079 -0.962 . . . . 0.0 110.404 173.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -58.1 -62.4 1.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.285 1.402 . . . . 0.0 112.277 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -55.6 -45.28 77.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.229 0.922 . . . . 0.0 112.519 -177.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -63.92 -38.61 91.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.534 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -60.96 -46.41 90.81 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.397 1.453 . . . . 0.0 112.502 170.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.94 -50.72 72.28 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.392 0.996 . . . . 0.0 111.866 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -57.02 -43.69 82.1 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.054 0.941 . . . . 0.0 112.166 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.07 85.97 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 119.102 0.864 . . . . 0.0 113.071 173.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -59.34 -44.38 92.66 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.736 0.815 . . . . 0.0 112.163 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.17 12.36 0.12 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.298 1.839 . . . . 0.0 115.216 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -128.93 -47.87 1.23 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.462 1.905 . . . . 0.0 110.961 169.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.23 154.57 7.82 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.434 -0.791 . . . . 0.0 111.602 177.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.2 t 67.44 17.39 10.08 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -51.61 -29.46 17.59 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 120.026 1.285 . . . . 0.0 114.036 169.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 66.83 8.82 6.3 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 127.941 2.496 . . . . 0.0 116.89 164.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -55.96 138.65 48.45 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.993 0.917 . . . . 0.0 111.965 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.7 m -75.78 55.43 0.87 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.247 1.419 . . . . 0.0 114.137 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -140.22 119.97 13.39 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.672 1.589 . . . . 0.0 109.343 172.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -152.37 87.64 1.33 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.439 0.696 . . . . 0.0 111.298 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.54 156.14 49.17 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.592 1.557 . . . . 0.0 109.974 171.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.467 1.907 . . . . 0.0 111.041 -179.063 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.238 0 CA-C-O 118.704 -1.053 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -129.05 163.83 24.56 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 118.747 1.274 . . . . 0.0 112.106 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 18.18 72.07 0.21 Allowed Pre-proline 0 N--CA 1.486 1.343 0 C-N-CA 128.874 2.87 . . . . 0.0 115.688 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.46 44.89 1.32 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 124.637 3.558 . . . . 0.0 112.71 175.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -156.47 142.38 17.96 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 127.222 2.209 . . . . 0.0 109.452 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.8 m -143.44 108.88 5.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.887 0.375 . . . . 0.0 109.99 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.7 161.03 15.8 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.956 0.902 . . . . 0.0 110.55 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -129.7 -165.11 1.48 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.201 1.8 . . . . 0.0 111.095 -166.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.33 144.42 53.99 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.962 -0.461 . . . . 0.0 109.792 156.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.32 -28.45 67.99 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.362 -1.461 . . . . 0.0 113.395 -174.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -68.84 -1.81 8.07 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.93 1.455 . . . . 0.0 114.93 170.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -104.82 -38.74 6.55 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.129 1.772 . . . . 0.0 111.031 166.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mm -55.43 -53.06 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.585 0.754 . . . . 0.0 111.352 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.92 -26.82 68.47 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -176.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.8 t -66.0 -51.44 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 120.405 1.457 . . . . 0.0 109.849 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -59.0 -47.12 86.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.608 0.763 . . . . 0.0 111.504 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.09 -30.32 66.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 117.183 -1.389 . . . . 0.0 114.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -66.28 -17.21 64.61 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 121.072 1.76 . . . . 0.0 112.948 166.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.62 -52.0 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 120.266 1.394 . . . . 0.0 111.859 161.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -55.47 -31.34 61.9 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.035 . . . . 0.0 113.722 178.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -53.27 -11.94 0.35 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 131.488 3.915 . . . . 0.0 115.423 168.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 44.2 t -132.77 -54.59 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 127.3 2.24 . . . . 0.0 110.703 175.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -100.87 92.0 4.85 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.731 1.613 . . . . 0.0 111.582 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.6 m -55.2 -32.35 62.15 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 176.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -144.69 97.33 5.01 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.386 1.875 . . . . 0.0 108.682 170.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -79.37 179.85 6.02 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.371 2.714 . . . . 0.0 113.116 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.21 162.16 54.46 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.253 0.93 . . . . 0.0 113.202 169.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 mm -68.04 -29.86 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 O-C-N 121.837 -0.802 . . . . 0.0 111.311 -178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.98 -33.47 75.81 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.373 1.869 . . . . 0.0 113.335 171.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.6 mm -71.42 -41.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 119.021 0.828 . . . . 0.0 110.434 170.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.44 -41.57 96.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.864 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.26 -50.41 74.09 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.876 2.07 . . . . 0.0 113.172 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -58.45 -41.02 84.19 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.595 1.089 . . . . 0.0 112.523 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.16 -48.64 72.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.053 0.941 . . . . 0.0 112.077 170.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -48.14 69.86 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.282 1.033 . . . . 0.0 111.864 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -55.88 -60.08 3.97 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.374 1.07 . . . . 0.0 112.394 171.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -65.43 -2.39 3.22 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.2 mt -128.26 -6.33 5.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.275 1.43 . . . . 0.0 113.701 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 43.45 73.15 0.15 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.067 1.347 . . . . 0.0 110.928 -158.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.45 -173.89 3.48 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.344 1.857 . . . . 0.0 109.199 171.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -137.2 150.13 47.68 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 125.273 1.429 . . . . 0.0 110.347 -177.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.2 tp -42.39 -54.34 3.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.796 1.239 . . . . 0.0 114.328 -171.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.07 -30.24 70.86 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.55 1.068 . . . . 0.0 113.684 -178.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -71.92 -37.5 70.04 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.962 1.255 . . . . 0.0 110.643 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -46.82 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.891 0.769 . . . . 0.0 111.454 171.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -54.37 -50.48 67.4 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.482 1.037 . . . . 0.0 112.135 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -62.3 -38.9 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 120.649 -1.282 . . . . 0.0 111.511 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -57.41 -57.34 13.08 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 120.324 1.42 . . . . 0.0 111.971 170.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -56.9 -48.58 77.89 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.286 1.034 . . . . 0.0 111.553 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -61.52 -41.29 97.1 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.07 0.948 . . . . 0.0 111.909 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.87 -41.53 95.6 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 120.512 1.506 . . . . 0.0 111.951 174.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -59.99 4.07 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.47 1.108 . . . . 0.0 112.079 172.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -54.08 -49.19 69.64 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.342 1.457 . . . . 0.0 111.45 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.36 74.19 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.906 0.775 . . . . 0.0 112.895 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -73.14 -32.99 65.25 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.4 mp -64.64 -52.73 55.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.871 0.76 . . . . 0.0 110.753 167.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.13 -50.15 73.7 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.052 1.341 . . . . 0.0 111.691 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -90.73 62.7 5.16 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.903 -1.123 . . . . 0.0 111.35 165.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -58.54 -53.14 61.74 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.489 0.316 . . . . 0.0 110.716 168.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -136.65 -152.76 0.46 Allowed 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.307 2.243 . . . . 0.0 109.867 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -115.72 142.93 46.09 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.883 1.273 . . . . 0.0 110.135 167.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -149.16 177.57 9.5 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.307 1.043 . . . . 0.0 110.811 166.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 t 50.35 38.07 16.95 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.469 1.508 . . . . 0.0 114.78 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -151.6 140.65 21.15 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.18 0.992 . . . . 0.0 110.391 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -118.21 167.38 11.56 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.556 1.142 . . . . 0.0 110.142 168.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.0 tp -154.0 127.03 8.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.772 1.229 . . . . 0.0 110.109 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.982 0 C-N-CA 125.637 1.575 . . . . 0.0 109.23 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.173 0 N-CA-C 108.59 -1.804 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -68.07 -19.83 64.91 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.065 1.432 . . . . 0.0 113.394 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -78.81 152.59 77.57 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.695 1.198 . . . . 0.0 112.293 168.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -75.9 56.51 4.79 Favored 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 125.03 3.82 . . . . 0.0 111.954 173.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.59 23.0 4.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.274 1.829 . . . . 0.0 114.05 -168.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 96.7 m -70.8 119.47 14.98 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.567 1.547 . . . . 0.0 112.034 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.51 172.34 7.4 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.687 1.195 . . . . 0.0 112.527 168.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -125.29 -166.59 1.56 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.939 2.096 . . . . 0.0 111.786 -171.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -76.59 152.71 35.83 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.074 0.95 . . . . 0.0 109.982 158.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -59.81 -38.71 82.72 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.435 -1.415 . . . . 0.0 113.044 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.83 -10.35 56.34 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -90.04 -47.43 7.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.771 1.628 . . . . 0.0 110.9 163.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.424 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 22.1 mm -50.94 -47.75 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.367 1.067 . . . . 0.0 111.972 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -61.02 -23.59 65.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.1 t -68.7 -50.76 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 120.063 1.301 . . . . 0.0 110.114 169.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.8 mp -62.13 -43.68 98.3 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 176.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.72 -42.45 79.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.778 -1.201 . . . . 0.0 113.651 169.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.5 -23.71 67.09 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 173.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.4 t -77.3 -47.0 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 119.91 1.232 . . . . 0.0 111.155 165.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -61.92 -30.96 71.24 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.85 1.66 . . . . 0.0 114.225 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -59.59 -17.99 37.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.076 1.307 . . . . 0.0 113.993 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.8 t -113.22 -37.64 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 126.556 1.943 . . . . 0.0 112.076 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -111.61 91.46 3.67 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.095 1.358 . . . . 0.0 112.274 -170.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -57.18 -30.5 64.56 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.472 -0.767 . . . . 0.0 112.868 167.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -139.46 114.83 8.18 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 127.854 2.462 . . . . 0.0 108.792 158.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -76.99 179.11 6.84 Favored 'Trans proline' 0 CA--C 1.55 1.31 0 C-N-CA 122.553 2.169 . . . . 0.0 110.724 167.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.71 166.02 39.07 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.442 -0.786 . . . . 0.0 113.196 170.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.2 mm -66.46 -36.89 78.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.848 -177.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.95 -26.56 68.27 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.608 1.549 . . . . 0.0 112.643 173.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.4 mm -74.55 -37.22 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.047 -1.033 . . . . 0.0 111.055 170.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 38.1 mt -67.5 -42.19 83.25 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.481 -0.762 . . . . 0.0 112.107 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.45 -49.02 77.59 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.788 1.635 . . . . 0.0 113.055 167.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -60.1 -43.41 95.59 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.458 1.026 . . . . 0.0 112.14 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.0 -45.89 93.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.883 0.873 . . . . 0.0 112.075 171.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.36 -51.56 67.86 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.228 1.011 . . . . 0.0 111.519 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -52.94 -63.51 1.12 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.944 1.297 . . . . 0.0 112.418 170.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -69.72 -13.67 62.41 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -171.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.75 1.76 13.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.465 1.106 . . . . 0.0 112.978 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 39.09 68.29 0.37 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.53 2.332 . . . . 0.0 112.856 -162.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.7 mt -120.45 -166.68 1.35 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.385 2.274 . . . . 0.0 109.036 171.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -134.19 159.19 41.66 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.812 -1.18 . . . . 0.0 110.504 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -44.69 -55.27 5.41 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.287 1.835 . . . . 0.0 112.2 -175.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -66.06 -27.37 68.04 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -65.88 -37.7 86.82 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 121.548 1.976 . . . . 0.0 110.766 171.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -41.71 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 118.342 0.519 . . . . 0.0 111.404 174.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -57.99 -52.99 63.22 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.099 0.863 . . . . 0.0 111.747 173.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.71 -36.14 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.96 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.424 ' HE1' ' CD1' ' A' ' 13' ' ' ILE . 71.2 t90 -61.89 -60.17 4.04 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.378 1.444 . . . . 0.0 112.218 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -59.74 -43.26 94.32 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.464 0.575 . . . . 0.0 111.385 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -49.03 79.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.918 175.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -59.16 -39.67 83.21 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.858 1.663 . . . . 0.0 111.461 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -62.98 1.43 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.194 0.998 . . . . 0.0 112.694 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.27 5.1 ptm180 -63.18 -35.36 80.05 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.992 1.269 . . . . 0.0 112.985 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.77 -18.49 65.37 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -131.69 17.97 4.74 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.766 1.226 . . . . 0.0 113.419 -173.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -43.18 -57.13 3.09 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.573 1.949 . . . . 0.0 113.665 -172.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.61 -16.72 64.39 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -76.37 34.84 0.14 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 0.0 113.715 169.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -63.16 168.93 3.81 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.894 -1.128 . . . . 0.0 111.906 171.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -66.85 -52.71 40.39 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.014 -1.054 . . . . 0.0 110.125 161.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.6 tpp85 -137.7 134.57 35.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.108 2.563 . . . . 0.0 108.61 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -81.88 123.43 28.82 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.015 0.825 . . . . 0.0 111.073 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.0 m -68.19 88.67 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.918 1.287 . . . . 0.0 113.353 -177.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -133.06 143.9 49.66 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.295 1.438 . . . . 0.0 109.525 162.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -153.99 179.72 8.65 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.385 0.674 . . . . 0.0 112.379 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 24.1 tp -125.59 169.3 12.62 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.54 1.936 . . . . 0.0 111.505 -172.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.2 ttp . . . . . 0 C--O 1.25 1.114 0 C-N-CA 125.175 1.39 . . . . 0.0 111.471 163.83 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.975 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -61.59 118.33 6.91 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.033 -175.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 53.68 123.71 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 131.342 3.857 . . . . 0.0 114.313 -164.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.46 65.96 7.28 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.696 2.93 . . . . 0.0 112.575 -176.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -125.76 58.22 1.33 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.406 1.882 . . . . 0.0 110.264 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -74.68 81.56 2.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.711 1.204 . . . . 0.0 112.661 -173.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -78.89 164.13 24.71 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.038 0.535 . . . . 0.0 111.202 160.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.406 ' H ' HD11 ' A' ' 13' ' ' ILE . 30.3 m-85 -129.46 -172.27 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.174 2.19 . . . . 0.0 110.422 172.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.3 t -70.86 148.7 47.53 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.026 -0.421 . . . . 0.0 110.468 164.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -49.62 -41.9 43.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.615 1.966 . . . . 0.0 113.874 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -16.59 61.48 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 120.33 1.423 . . . . 0.0 113.838 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -84.12 -40.68 17.94 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.496 1.119 . . . . 0.0 110.32 167.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.406 HD11 ' H ' ' A' ' 8' ' ' PHE . 26.5 mm -54.0 -51.59 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.104 0.962 . . . . 0.0 111.586 171.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.0 -37.24 66.34 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 85.3 t -66.67 -47.63 82.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.334 1.425 . . . . 0.0 110.857 174.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.76 -43.87 95.15 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.572 1.149 . . . . 0.0 112.22 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -49.87 -55.52 14.01 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.652 1.581 . . . . 0.0 111.087 164.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 -58.27 -12.94 4.15 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.899 1.815 . . . . 0.0 115.899 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 98.9 t -86.76 -49.62 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 120.714 1.597 . . . . 0.0 111.701 161.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -54.09 -30.53 48.83 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.342 1.057 . . . . 0.0 113.78 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -53.63 -28.13 31.11 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.783 1.233 . . . . 0.0 114.038 175.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.1 t -110.2 -48.92 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.876 2.07 . . . . 0.0 111.451 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -110.62 82.83 1.66 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.798 1.239 . . . . 0.0 111.667 -175.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.3 m -54.4 -33.88 60.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.272 -0.893 . . . . 0.0 112.501 169.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -124.9 103.03 31.05 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 126.757 2.023 . . . . 0.0 108.971 167.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -81.18 176.37 8.87 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.859 3.039 . . . . 0.0 112.739 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.94 163.45 31.92 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.519 1.057 . . . . 0.0 112.876 169.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.9 mm -59.43 -38.11 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.019 1.328 . . . . 0.0 111.127 -177.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.52 -27.57 61.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.759 2.024 . . . . 0.0 112.325 -177.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 57.5 mt -76.45 -39.85 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 170.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.5 mt -62.06 -46.18 90.25 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.682 0.793 . . . . 0.0 111.344 172.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.85 -49.93 75.02 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 165.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.47 -30.35 66.91 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.22 1.827 . . . . 0.0 114.614 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -70.57 -49.76 44.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.842 0.857 . . . . 0.0 112.263 167.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.37 64.07 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.671 1.189 . . . . 0.0 112.324 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.73 -12.36 46.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.595 2.758 . . . . 0.0 114.012 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -118.74 -34.89 3.83 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.849 1.26 . . . . 0.0 113.873 -176.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.9 mt -85.95 -13.36 47.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.96 0.904 . . . . 0.0 113.058 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 67.97 65.84 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.285 2.234 . . . . 0.0 111.856 -169.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.9 mt -139.36 177.93 7.56 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.221 2.208 . . . . 0.0 109.699 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -115.46 158.85 21.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.83 1.252 . . . . 0.0 112.002 165.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.19 -41.27 68.38 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.492 1.117 . . . . 0.0 113.796 -169.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -33.74 73.66 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.478 1.035 . . . . 0.0 113.257 176.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -68.69 -39.25 80.64 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.628 -1.295 . . . . 0.0 110.546 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.61 -47.72 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.04 171.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -54.65 -49.98 69.29 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.751 1.159 . . . . 0.0 111.912 175.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.5 mt -62.5 -38.04 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 117.558 -1.211 . . . . 0.0 111.222 174.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -58.44 -58.21 9.54 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 121.029 1.74 . . . . 0.0 111.542 170.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -54.1 -51.39 64.33 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 118.91 0.777 . . . . 0.0 112.743 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.54 -40.59 83.41 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 118.21 -0.9 . . . . 0.0 112.275 174.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -62.35 -46.66 87.67 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 120.771 1.623 . . . . 0.0 112.896 174.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -61.57 -46.79 88.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 120.151 1.341 . . . . 0.0 111.529 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -47.3 85.69 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.801 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.72 -54.13 49.9 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.54 1.136 . . . . 0.0 111.623 173.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -56.45 -38.03 71.09 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.533 1.133 . . . . 0.0 112.692 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.38 -45.95 65.01 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.315 1.046 . . . . 0.0 112.179 176.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -63.62 -28.68 70.09 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.942 0.897 . . . . 0.0 112.129 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.262 5.8 ttt180 46.75 -44.91 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.295 1 C-N-CA 134.914 5.286 . . . . 0.0 117.9 177.621 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.0 t 54.23 27.12 7.45 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.647 1.979 . . . . 0.0 115.477 168.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.91 172.03 10.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.654 1.182 . . . . 0.0 112.747 -175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -126.01 126.65 44.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.829 1.252 . . . . 0.0 110.65 163.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 50.9 -175.93 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.097 2.159 . . . . 0.0 113.894 -169.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.2 t -169.41 169.66 8.83 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.435 1.894 . . . . 0.0 109.649 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.11 144.26 36.67 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.798 1.239 . . . . 0.0 109.888 159.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -152.13 178.75 9.14 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.266 0.555 . . . . 0.0 112.373 -175.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 tp -119.61 -172.8 2.4 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.017 1.727 . . . . 0.0 111.316 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.253 1.421 . . . . 0.0 110.322 169.304 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.759 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -97.85 160.75 14.11 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.98 1.712 . . . . 0.0 112.613 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 80.13 124.44 0.03 OUTLIER Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 130.18 3.392 . . . . 0.0 113.56 175.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -76.06 68.59 6.55 Favored 'Trans proline' 0 CA--C 1.548 1.21 0 C-N-CA 122.977 2.451 . . . . 0.0 112.148 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 50.22 1.84 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.236 1.415 . . . . 0.0 112.385 176.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -59.73 123.53 17.25 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.948 1.699 . . . . 0.0 113.272 179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -128.18 171.22 12.14 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.118 1.767 . . . . 0.0 110.816 161.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -137.76 -176.66 4.5 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.321 1.848 . . . . 0.0 111.961 -175.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.2 t -66.81 147.07 53.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.265 0.626 . . . . 0.0 110.784 166.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -55.17 -35.37 64.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.42 1.088 . . . . 0.0 113.218 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -5.53 32.34 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 125.266 1.427 . . . . 0.0 114.707 175.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -109.15 -33.3 6.92 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.49 1.916 . . . . 0.0 111.143 167.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -55.27 -51.96 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.28 1.032 . . . . 0.0 111.343 167.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -57.2 -34.42 68.5 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.7 t -69.1 -39.34 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 119.952 1.251 . . . . 0.0 110.173 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.6 mt -69.13 -46.99 66.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.376 1.07 . . . . 0.0 111.495 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -58.19 -39.22 78.37 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.093 0.86 . . . . 0.0 112.523 170.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -61.91 -27.97 69.2 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.843 -1.161 . . . . 0.0 114.121 172.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.2 t -76.5 -50.77 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 119.975 1.261 . . . . 0.0 111.098 166.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.57 -34.48 71.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.571 1.148 . . . . 0.0 113.62 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -65.25 -17.81 64.8 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 174.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.9 t -98.48 -45.81 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.759 1.623 . . . . 0.0 110.77 174.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -133.25 108.03 8.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.456 1.102 . . . . 0.0 112.952 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.5 t -51.3 -39.86 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.043 1.737 . . . . 0.0 113.002 169.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.38 92.52 20.55 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 126.278 1.831 . . . . 0.0 110.533 175.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.26 176.46 10.07 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 123.185 2.59 . . . . 0.0 112.636 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.96 170.52 45.57 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.679 1.133 . . . . 0.0 114.647 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 21.8 mm -66.44 -34.89 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.716 -0.873 . . . . 0.0 111.769 -175.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.16 -29.88 70.06 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.171 1.389 . . . . 0.0 112.574 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mm -76.22 -40.82 36.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.118 0.967 . . . . 0.0 109.698 174.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.47 -47.74 82.67 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.723 -0.61 . . . . 0.0 112.06 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.72 -55.92 26.56 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.963 1.305 . . . . 0.0 112.401 168.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -62.8 -22.23 66.48 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.24 -1.538 . . . . 0.0 114.013 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -76.42 -50.04 15.17 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.016 -1.052 . . . . 0.0 112.138 164.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.4 -53.28 47.05 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.374 1.47 . . . . 0.0 111.921 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -64.17 -12.7 42.65 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.221 1.408 . . . . 0.0 114.15 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 33.3 ttmt -123.23 -47.05 2.03 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.745 1.157 . . . . 0.0 114.002 -164.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.58 -17.06 61.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.526 1.13 . . . . 0.0 112.922 168.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 71.2 74.12 0.18 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.667 2.787 . . . . 0.0 111.191 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -142.3 175.44 9.76 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.367 1.867 . . . . 0.0 109.654 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -99.27 148.96 23.6 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 121.658 -0.652 . . . . 0.0 110.324 162.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 tt -42.83 -48.13 5.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.184 1.393 . . . . 0.0 112.937 175.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.09 -41.3 87.74 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -65.16 -34.87 79.41 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.595 -1.316 . . . . 0.0 111.646 175.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.0 mt -74.6 -42.51 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 118.703 -0.665 . . . . 0.0 112.177 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -52.49 -52.65 53.35 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.249 1.42 . . . . 0.0 111.882 170.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.82 -43.66 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 123.895 0.878 . . . . 0.0 110.693 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 84.4 t90 -55.87 -53.07 61.27 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.99 1.268 . . . . 0.0 112.496 172.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -59.03 -47.48 85.07 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 118.704 0.684 . . . . 0.0 111.671 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -47.22 83.84 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.288 0.949 . . . . 0.0 111.573 176.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -63.03 -39.4 94.64 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.986 1.266 . . . . 0.0 112.515 177.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.4 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -55.98 -54.63 42.51 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.74 -1.225 . . . . 0.0 112.547 168.95 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -28.75 67.17 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.276 1.43 . . . . 0.0 113.718 -175.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.35 -32.11 64.35 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 167.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -69.53 -57.95 4.57 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 117.469 -1.253 . . . . 0.0 112.825 172.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp 30.33 59.39 0.21 Allowed 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 126.079 1.752 . . . . 0.0 112.711 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.258 42.7 pttt 50.43 5.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 120.203 3.409 . . . . 0.0 120.203 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 12.09 -78.45 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 128.066 2.546 . . . . 0.0 117.347 -166.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.5 m -114.77 17.74 16.92 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.523 1.929 . . . . 0.0 114.048 -168.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -125.95 161.41 27.55 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.24 -1.538 . . . . 0.0 113.619 -176.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmp_? -61.56 -56.0 24.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.665 1.586 . . . . 0.0 112.687 173.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 52.23 16.16 0.54 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.851 2.06 . . . . 0.0 115.64 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 p -69.15 98.2 0.98 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.464 1.506 . . . . 0.0 112.728 176.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.1 123.43 14.79 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.325 1.85 . . . . 0.0 108.218 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -150.73 141.56 22.83 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.932 1.293 . . . . 0.0 111.238 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -156.8 -62.3 0.1 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.904 1.282 . . . . 0.0 112.939 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 C--O 1.252 1.222 0 C-N-CA 129.144 2.978 . . . . 0.0 111.042 -174.906 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.167 0 CA-C-O 118.479 -1.178 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -61.69 59.7 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 129.062 2.945 . . . . 0.0 117.082 -175.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -134.94 167.77 21.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 127.802 2.441 . . . . 0.0 110.993 170.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -78.9 171.67 16.16 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.824 2.35 . . . . 0.0 113.034 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.57 123.21 42.61 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.571 1.548 . . . . 0.0 108.237 166.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 52.4 m 64.1 -80.77 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.35 1.46 . . . . 0.0 114.594 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 50.81 170.07 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 126.497 1.919 . . . . 0.0 115.458 -161.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -135.93 -174.04 3.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.575 1.95 . . . . 0.0 111.301 -168.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -75.79 152.5 37.32 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.515 -0.741 . . . . 0.0 110.434 164.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.09 -25.96 64.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -72.06 -3.07 20.87 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.981 1.719 . . . . 0.0 114.573 171.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -110.08 -33.41 6.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.635 1.974 . . . . 0.0 111.405 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mm -63.04 -44.53 99.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.595 0 CA-C-O 117.649 -1.167 . . . . 0.0 111.44 170.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -54.63 -43.89 72.67 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.69 1.586 . . . . 0.0 113.763 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 39.4 t -66.87 -39.98 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.091 0.859 . . . . 0.0 110.47 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.21 -46.35 64.71 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.461 1.105 . . . . 0.0 112.403 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -64.31 -36.13 83.12 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.775 -1.203 . . . . 0.0 112.609 171.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -59.34 -46.34 88.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.659 1.118 . . . . 0.0 112.601 169.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 87.8 t -64.76 -43.25 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 121.256 -0.903 . . . . 0.0 111.241 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -54.86 -43.0 72.72 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.704 1.138 . . . . 0.0 112.63 174.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -63.9 -13.1 42.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.362 2.265 . . . . 0.0 114.525 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.35 -41.96 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.955 1.702 . . . . 0.0 111.476 169.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -143.87 104.13 4.13 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.414 2.286 . . . . 0.0 110.234 -174.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 72.0 m -57.49 -22.26 42.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -158.78 82.47 2.62 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.702 2.001 . . . . 0.0 110.181 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.41 177.9 8.04 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.335 2.69 . . . . 0.0 111.956 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.43 167.31 54.81 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 121.785 -0.572 . . . . 0.0 114.337 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.1 mm -58.3 -47.34 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.802 0 C-N-CA 124.148 0.979 . . . . 0.0 111.667 -173.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -62.59 -26.13 68.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.132 0.973 . . . . 0.0 112.767 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.3 mm -74.47 -44.86 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.654 1.182 . . . . 0.0 110.285 172.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.3 mt -63.27 -39.77 95.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.878 0.871 . . . . 0.0 111.544 173.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -74.01 -33.82 63.94 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.181 1.393 . . . . 0.0 114.458 175.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.73 -41.8 91.72 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.932 1.696 . . . . 0.0 112.158 166.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -61.78 -51.29 68.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.321 0.648 . . . . 0.0 111.402 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.74 -44.06 66.17 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.209 1.004 . . . . 0.0 112.533 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -20.48 27.95 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.644 1.977 . . . . 0.0 114.864 177.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -118.31 -36.98 3.42 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.919 1.236 . . . . 0.0 113.53 -176.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.7 mt -73.61 -9.55 58.79 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.1 1.36 . . . . 0.0 113.456 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 48.26 77.29 0.1 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.509 2.324 . . . . 0.0 112.425 -165.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.86 -179.46 5.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.085 2.554 . . . . 0.0 108.35 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -112.59 159.59 18.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.693 1.597 . . . . 0.0 111.623 164.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.63 -46.67 40.18 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.077 1.351 . . . . 0.0 111.981 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -54.95 -53.42 55.85 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.81 1.244 . . . . 0.0 113.653 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -68.0 -31.8 71.75 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.092 0.86 . . . . 0.0 111.923 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -42.28 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.378 0.99 . . . . 0.0 111.029 169.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -57.74 -54.22 49.36 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.844 1.258 . . . . 0.0 112.019 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.53 -35.69 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.199 -0.938 . . . . 0.0 111.222 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -59.46 -56.45 21.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.724 1.602 . . . . 0.0 112.369 170.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.66 -43.23 94.0 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.858 0.863 . . . . 0.0 111.991 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -55.85 -47.63 76.94 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.854 1.262 . . . . 0.0 110.284 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -74.84 3.3 8.37 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 174.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.41 -64.27 1.17 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 109.921 152.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -45.3 72.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.722 1.209 . . . . 0.0 112.951 -172.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.9 -5.31 29.74 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -134.31 15.5 3.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.898 1.279 . . . . 0.0 113.499 -178.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.4 tt -43.14 -52.2 5.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.402 1.881 . . . . 0.0 113.812 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -62.72 -32.84 74.02 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 62.94 149.49 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.468 2.307 . . . . 0.0 115.172 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.0 m -68.23 35.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 128.47 2.708 . . . . 0.0 114.66 167.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -144.71 88.26 1.9 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.196 1.398 . . . . 0.0 110.375 -172.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 77.36 135.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 127.943 2.497 . . . . 0.0 113.269 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -61.71 98.49 0.09 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.744 2.418 . . . . 0.0 110.571 -174.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 m -126.89 92.91 3.63 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.205 -0.934 . . . . 0.0 112.511 -165.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -66.83 132.26 47.65 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.644 0.778 . . . . 0.0 112.965 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -150.43 147.59 27.73 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.423 2.689 . . . . 0.0 108.125 168.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 97.5 mt -132.36 168.69 17.68 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.357 1.463 . . . . 0.0 110.323 173.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 25.1 ptp . . . . . 0 C--O 1.248 1.014 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.307 174.276 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.165 0 CA-C-O 118.912 -0.938 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -57.95 100.14 0.05 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.07 1.748 . . . . 0.0 112.733 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -149.36 165.69 17.05 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 128.256 2.622 . . . . 0.0 111.317 -179.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -75.45 -175.96 2.7 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 124.944 3.763 . . . . 0.0 114.551 -177.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? 47.17 59.95 3.73 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 128.242 2.617 . . . . 0.0 113.715 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.1 m -64.81 134.17 53.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.833 1.653 . . . . 0.0 112.609 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -136.76 164.56 27.99 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.999 1.32 . . . . 0.0 111.128 165.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -128.15 179.91 5.34 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.337 1.855 . . . . 0.0 112.229 -171.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.9 t -59.34 146.52 39.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 0.0 111.078 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -55.67 -36.82 67.5 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.495 -0.753 . . . . 0.0 112.981 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -16.31 45.0 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.466 1.107 . . . . 0.0 113.192 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -99.09 -46.45 5.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.006 1.722 . . . . 0.0 111.132 170.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 mm -47.85 -49.09 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.635 1.174 . . . . 0.0 111.848 174.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.95 -31.03 38.18 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.861 1.264 . . . . 0.0 113.674 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.8 t -71.66 -42.94 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 120.844 -1.16 . . . . 0.0 111.232 175.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 mp -67.23 -47.52 70.56 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.647 0.779 . . . . 0.0 111.474 175.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.19 -47.76 65.38 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.688 1.195 . . . . 0.0 111.403 170.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -55.51 -41.7 73.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.08 -47.46 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.497 1.044 . . . . 0.0 111.521 171.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -60.0 -24.01 64.13 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.861 1.664 . . . . 0.0 114.148 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -58.32 -52.3 66.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.523 1.129 . . . . 0.0 111.465 167.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.9 t -75.03 -46.7 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.701 1.6 . . . . 0.0 111.902 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -138.12 112.11 8.45 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.941 0.897 . . . . 0.0 111.455 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.7 p -72.94 -14.71 61.51 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -132.43 76.91 71.29 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.516 2.326 . . . . 0.0 110.494 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.02 159.23 54.79 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.566 2.177 . . . . 0.0 112.547 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.68 166.76 52.41 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 123.725 0.678 . . . . 0.0 112.136 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.659 HD12 ' H ' ' A' ' 28' ' ' ILE . 3.2 mp -64.12 -35.04 72.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 121.803 -0.822 . . . . 0.0 110.698 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.53 -23.96 63.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.975 1.31 . . . . 0.0 113.143 175.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.8 mt -82.89 -37.44 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.152 0.981 . . . . 0.0 109.721 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 39.4 mt -63.06 -47.88 81.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.874 0.869 . . . . 0.0 111.041 167.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -64.72 -35.75 82.06 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 172.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -53.67 -51.89 61.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.946 1.703 . . . . 0.0 110.982 166.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -57.9 -45.7 86.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 173.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.82 -53.22 59.32 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.999 0.818 . . . . 0.0 112.163 175.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -69.8 -27.84 65.23 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.9 1.28 . . . . 0.0 113.553 -174.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -92.94 -24.21 18.48 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.117 1.326 . . . . 0.0 114.455 177.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.2 mt -93.83 -17.38 23.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.28 66.14 0.64 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.454 1.901 . . . . 0.0 111.759 -166.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.46 -175.62 3.64 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.533 2.333 . . . . 0.0 108.953 167.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 pm0 -119.07 153.39 34.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.091 1.756 . . . . 0.0 111.776 169.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.27 -46.48 35.89 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.329 1.852 . . . . 0.0 112.292 -173.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -51.64 -43.77 62.74 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.53 1.532 . . . . 0.0 114.469 175.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -66.61 -41.6 88.16 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.291 -0.88 . . . . 0.0 111.086 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -38.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 118.235 0.47 . . . . 0.0 111.422 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -60.77 -52.5 64.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.07 1.348 . . . . 0.0 111.852 173.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.67 -43.86 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.39 -0.819 . . . . 0.0 110.597 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.441 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 66.7 t90 -58.97 -56.65 19.5 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.617 1.099 . . . . 0.0 112.249 176.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -63.81 -39.52 94.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.119 0.872 . . . . 0.0 112.675 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -62.52 -47.83 82.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.599 1.091 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -60.18 -42.19 94.5 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.797 1.18 . . . . 0.0 111.771 174.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.441 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -62.45 -52.08 64.95 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.063 0.945 . . . . 0.0 113.05 178.608 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -41.83 98.27 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 117.099 -1.429 . . . . 0.0 111.142 176.02 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.63 -54.2 48.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.576 1.08 . . . . 0.0 112.345 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -55.24 -51.35 66.88 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 120.94 -1.1 . . . . 0.0 112.215 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -68.02 11.65 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 125.557 1.543 . . . . 0.0 114.553 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -126.97 -14.57 5.53 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 120.128 -1.608 . . . . 0.0 114.322 160.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -73.72 -53.44 10.35 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.128 1.371 . . . . 0.0 111.686 165.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.8 m -83.4 49.17 1.52 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.956 1.703 . . . . 0.0 113.675 -169.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -141.67 86.67 2.01 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.03 2.132 . . . . 0.0 106.568 161.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' HB3' ' H ' ' A' ' 62' ' ' GLU . 0.0 OUTLIER -148.76 -111.24 0.07 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.361 1.064 . . . . 0.0 110.863 -170.262 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.407 ' H ' ' HB3' ' A' ' 61' ' ' ARG . 12.5 mp0 -63.29 116.82 5.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.173 1.789 . . . . 0.0 112.505 173.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 m -77.31 62.67 2.38 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.65 1.18 . . . . 0.0 112.181 178.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -126.91 105.09 8.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.463 1.105 . . . . 0.0 112.696 -167.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -71.99 152.01 42.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.125 -0.359 . . . . 0.0 110.095 158.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.0 tp -105.64 -115.48 0.24 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.992 0.917 . . . . 0.0 110.819 -175.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.4 tmm? . . . . . 0 C--O 1.246 0.869 0 C-N-CA 126.715 2.006 . . . . 0.0 108.906 178.679 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.826 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -64.32 -71.17 0.19 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.728 2.011 . . . . 0.0 114.855 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -143.48 86.4 8.92 Favored Pre-proline 0 N--CA 1.484 1.237 0 C-N-CA 126.702 2.001 . . . . 0.0 110.56 -171.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -72.6 177.3 7.65 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.992 2.461 . . . . 0.0 112.6 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.37 141.58 8.7 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.621 -0.674 . . . . 0.0 111.581 169.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.6 m -125.71 144.56 50.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.64 0.776 . . . . 0.0 111.755 -163.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -124.97 173.58 8.56 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.567 1.547 . . . . 0.0 111.642 172.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -131.32 -173.19 3.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.543 2.337 . . . . 0.0 110.212 -174.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.0 t -63.14 147.99 49.26 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.479 -0.763 . . . . 0.0 110.397 160.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -53.02 -34.14 54.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.407 172.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -26.67 64.43 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.512 1.051 . . . . 0.0 112.909 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -82.67 -53.48 5.89 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 126.175 1.79 . . . . 0.0 110.12 171.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.412 HD12 ' HE1' ' A' ' 48' ' ' TRP . 18.7 mm -53.48 -44.15 55.08 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 C-N-CA 125.101 1.36 . . . . 0.0 111.328 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -54.23 -40.9 68.12 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.805 1.184 . . . . 0.0 112.578 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.39 -46.31 90.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.452 -1.405 . . . . 0.0 110.768 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.416 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 5.3 mp -61.74 -48.89 78.66 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 174.045 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.21 -52.05 60.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.992 1.717 . . . . 0.0 112.669 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -71.92 -20.33 61.78 Favored 'General case' 0 CA--C 1.553 1.082 0 CA-C-N 119.098 0.863 . . . . 0.0 112.396 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.7 t -68.0 -55.3 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 119.876 1.217 . . . . 0.0 111.329 161.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -53.85 -38.92 65.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.758 1.623 . . . . 0.0 112.775 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.4 ttt85 -56.16 -24.38 40.88 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 127.102 2.161 . . . . 0.0 114.768 172.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.82 -26.36 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 126.111 1.764 . . . . 0.0 112.524 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -135.48 96.12 3.4 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.367 1.467 . . . . 0.0 111.18 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 71.6 m -64.89 -9.97 25.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.067 1.747 . . . . 0.0 114.876 -176.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -157.51 88.96 2.48 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 126.537 1.935 . . . . 0.0 109.642 169.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.37 161.24 43.12 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.798 1.665 . . . . 0.0 112.196 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.04 166.33 48.34 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.625 0.631 . . . . 0.0 113.31 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.12 -43.16 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.052 0.941 . . . . 0.0 112.148 -172.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -70.57 -20.14 62.81 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -176.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.6 mm -79.37 -38.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.52 1.128 . . . . 0.0 110.744 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.8 mt -64.52 -43.94 92.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.84 0.856 . . . . 0.0 111.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -58.64 -50.75 72.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.948 1.699 . . . . 0.0 113.208 167.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -55.09 -42.33 72.73 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.277 1.399 . . . . 0.0 112.249 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 mt -62.77 -46.82 86.24 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.506 -0.746 . . . . 0.0 112.206 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.73 -52.27 66.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.356 0.98 . . . . 0.0 111.817 177.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.36 -44.46 80.13 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.319 1.848 . . . . 0.0 112.616 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -101.89 -15.1 16.97 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -167.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.4 mt -95.31 -5.76 42.78 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.912 1.285 . . . . 0.0 113.039 171.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 53.63 71.3 0.51 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.647 1.979 . . . . 0.0 112.521 -165.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.6 mt -133.41 -178.8 5.15 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.164 2.185 . . . . 0.0 109.558 171.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.59 141.5 47.68 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.155 0.982 . . . . 0.0 110.385 173.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -46.39 -51.94 13.93 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.663 1.585 . . . . 0.0 111.9 -175.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -57.65 -41.97 82.54 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.194 0.998 . . . . 0.0 112.812 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.13 -35.33 80.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.596 -1.315 . . . . 0.0 111.758 174.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.6 mt -73.12 -38.3 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.228 0.922 . . . . 0.0 111.857 175.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -57.67 -56.19 25.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.883 1.22 . . . . 0.0 111.979 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.2 mp -59.26 -37.81 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 117.297 -1.335 . . . . 0.0 110.889 174.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.416 ' CZ3' ' HB3' ' A' ' 16' ' ' LEU . 80.7 t90 -55.58 -63.83 1.04 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.054 1.752 . . . . 0.0 111.164 170.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -55.72 -45.14 78.0 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.685 1.129 . . . . 0.0 112.354 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.96 -37.19 86.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 118.282 -0.866 . . . . 0.0 112.736 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -62.21 -46.69 87.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.178 1.354 . . . . 0.0 111.57 171.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.408 ' HG3' ' CH2' ' A' ' 48' ' ' TRP . 18.1 mmm180 -55.06 -53.76 51.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.086 0.857 . . . . 0.0 111.559 176.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -60.53 -44.85 95.62 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.706 0.802 . . . . 0.0 112.111 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.61 -48.42 81.03 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 171.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.98 -43.48 98.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.049 1.34 . . . . 0.0 112.661 -178.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.25 -29.44 70.54 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.08 0.855 . . . . 0.0 112.3 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -80.66 -44.14 19.29 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 58.8 mtt85 51.94 -161.6 0.09 Allowed 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.178 1.391 . . . . 0.0 112.791 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.3 m -64.49 153.45 38.9 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.906 -1.121 . . . . 0.0 110.869 158.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -69.67 146.12 51.86 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.44 0.638 . . . . 0.0 111.939 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -148.16 98.16 2.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 -168.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -78.4 93.58 4.74 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -173.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 76.5 p -120.68 173.33 7.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.392 1.477 . . . . 0.0 112.63 168.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -138.96 -177.48 4.9 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.286 1.834 . . . . 0.0 110.197 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -146.95 163.88 34.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.977 0.911 . . . . 0.0 111.458 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.2 tp -138.59 -174.05 3.72 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.987 1.715 . . . . 0.0 111.856 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.3 ttt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.958 1.703 . . . . 0.0 111.424 179.039 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 109.989 -1.244 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.1 mtm105 -95.89 -170.66 2.17 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.379 1.472 . . . . 0.0 112.653 -169.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 64.7 169.52 0.1 OUTLIER Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 128.39 2.676 . . . . 0.0 114.219 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.42 176.85 9.12 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.964 2.443 . . . . 0.0 112.237 171.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.84 113.76 0.51 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.58 1.152 . . . . 0.0 109.488 162.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.4 m -95.14 158.81 15.3 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.818 1.247 . . . . 0.0 110.478 -176.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.82 171.38 14.3 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.939 1.696 . . . . 0.0 110.107 169.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -135.37 -170.01 2.51 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.79 2.036 . . . . 0.0 111.128 -178.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -73.75 146.17 44.55 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.223 -0.923 . . . . 0.0 110.979 159.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -56.88 -31.59 65.0 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.656 1.183 . . . . 0.0 113.586 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -21.97 63.46 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.188 -0.945 . . . . 0.0 113.071 173.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -75.41 -54.16 7.52 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.767 1.227 . . . . 0.0 108.687 164.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.5 mm -48.64 -50.47 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.003 1.321 . . . . 0.0 112.118 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -59.36 -26.92 65.48 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -64.54 -51.97 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 122.027 2.194 . . . . 0.0 110.471 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.42 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 2.6 mm? -59.87 -46.08 90.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 112.603 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.75 -49.06 66.24 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.779 1.232 . . . . 0.0 113.07 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -65.76 -15.31 62.73 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.5 t -83.43 -50.04 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 119.277 0.944 . . . . 0.0 111.193 161.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -55.5 -38.82 69.66 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.422 . . . . 0.0 113.999 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.61 -7.5 33.47 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.5 t -119.05 -35.18 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.981 1.712 . . . . 0.0 111.727 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -139.73 93.92 2.71 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 128.585 2.754 . . . . 0.0 109.229 179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.9 p -59.0 -26.39 64.47 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -140.88 106.1 6.28 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.43 1.892 . . . . 0.0 108.87 159.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.68 -179.83 5.82 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 123.265 2.643 . . . . 0.0 111.779 174.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.86 167.8 54.35 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.001 0.81 . . . . 0.0 114.299 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.0 mm -61.65 -41.55 90.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.005 0.922 . . . . 0.0 111.669 -176.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.52 -31.0 67.5 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 125.968 1.707 . . . . 0.0 112.832 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.8 mm -76.52 -38.78 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.577 0.751 . . . . 0.0 110.365 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.17 -44.6 96.25 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.539 -0.725 . . . . 0.0 112.063 170.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -65.26 -41.38 94.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.19 1.796 . . . . 0.0 114.34 172.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.66 -43.5 93.41 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.683 1.128 . . . . 0.0 111.736 172.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.1 mt -61.25 -42.03 97.92 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.591 -1.318 . . . . 0.0 111.704 172.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.86 -58.63 7.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.236 1.014 . . . . 0.0 111.239 174.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -64.99 -37.2 86.89 Favored 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -70.41 -41.86 72.38 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.497 -1.377 . . . . 0.0 114.483 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 47.4 mt -90.85 -1.91 57.8 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.112 1.365 . . . . 0.0 112.696 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 48.64 50.51 17.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.07 2.548 . . . . 0.0 113.895 -170.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.0 mt -108.57 171.83 7.19 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.223 1.809 . . . . 0.0 110.037 170.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -93.89 140.01 30.21 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.509 1.147 . . . . 0.0 110.927 159.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -16.01 59.37 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -173.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.33 -43.7 80.92 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.735 1.614 . . . . 0.0 111.355 170.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -63.35 -38.59 91.75 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.719 -1.238 . . . . 0.0 111.491 171.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.6 mt -69.42 -41.32 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.504 175.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.5 mt-30 -53.85 -52.67 59.68 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.289 0.95 . . . . 0.0 112.387 169.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.06 -42.43 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.302 172.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.424 ' CZ2' ' HD3' ' A' ' 52' ' ' ARG . 87.1 t90 -56.81 -52.99 62.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 121.013 1.733 . . . . 0.0 112.283 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -61.8 -48.54 80.14 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 118.417 0.553 . . . . 0.0 112.239 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -55.48 -39.7 70.74 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.441 1.019 . . . . 0.0 112.136 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -61.31 -43.12 99.39 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.343 -1.473 . . . . 0.0 112.779 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HD3' ' CZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -58.25 -58.95 6.21 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.148 0.885 . . . . 0.0 111.75 171.142 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -30.23 71.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.76 0.824 . . . . 0.0 111.715 -172.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.66 -58.11 9.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.924 . . . . 0.0 112.028 165.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.92 -50.38 61.23 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.762 0.825 . . . . 0.0 111.32 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.1 tt -58.1 -10.2 1.78 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.666 1.986 . . . . 0.0 114.726 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 7.06 7.7 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 170.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 14.0 ttt85 -76.2 -169.26 1.11 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.484 1.914 . . . . 0.0 109.63 162.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.0 m 22.06 79.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 128.24 2.616 . . . . 0.0 114.585 154.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -71.65 61.86 0.38 Allowed 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -162.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -151.1 80.43 1.31 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 128.93 2.892 . . . . 0.0 108.631 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -162.77 152.59 15.88 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.448 1.899 . . . . 0.0 108.211 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.2 m -68.89 88.57 0.39 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.614 1.097 . . . . 0.0 112.588 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -54.41 -66.57 0.38 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.598 1.559 . . . . 0.0 113.616 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -145.47 110.14 5.07 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.049 1.339 . . . . 0.0 111.214 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.2 mt 50.18 59.43 4.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.762 1.625 . . . . 0.0 112.601 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.12 1.768 . . . . 0.0 110.671 -174.106 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.036 0 N-CA-C 108.119 -1.992 . . . . 0.0 108.119 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.41 ' H ' ' HD3' ' A' ' 2' ' ' ARG . 0.0 OUTLIER 0.58 -91.62 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 129.469 3.108 . . . . 0.0 114.984 173.025 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -162.26 84.1 1.61 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 0.0 110.164 -167.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.89 82.37 1.52 Allowed 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.195 2.596 . . . . 0.0 111.301 179.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.92 -6.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 129.626 3.171 . . . . 0.0 116.805 -172.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.5 m 32.96 -84.59 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 130.443 3.497 . . . . 0.0 113.331 -161.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 48.45 171.03 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 128.083 2.553 . . . . 0.0 115.428 -168.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -137.58 -174.72 3.85 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.642 1.977 . . . . 0.0 110.276 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -66.79 148.83 51.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.878 0.471 . . . . 0.0 110.701 159.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -57.49 -31.65 66.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.902 0.774 . . . . 0.0 112.158 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -14.16 60.22 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.32 -43.75 10.14 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.185 1.794 . . . . 0.0 110.738 168.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.7 mm -55.38 -53.64 33.54 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 C-N-CA 125.006 1.323 . . . . 0.0 110.684 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -58.14 -32.15 67.89 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.125 1.329 . . . . 0.0 114.109 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.73 -45.18 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 120.086 1.312 . . . . 0.0 110.425 173.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.59 -48.06 76.35 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.782 1.233 . . . . 0.0 112.042 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.76 -45.21 78.13 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.964 1.705 . . . . 0.0 111.628 170.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -61.9 -27.09 68.56 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.55 -47.8 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 CA-C-N 120.082 1.31 . . . . 0.0 111.643 166.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -54.91 -32.77 61.43 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.561 1.073 . . . . 0.0 113.027 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -57.23 -25.63 59.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.061 2.545 . . . . 0.0 115.021 171.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.35 -31.03 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.173 1.389 . . . . 0.0 114.263 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -131.71 76.39 1.71 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.536 1.934 . . . . 0.0 109.423 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.1 p -59.71 -27.02 66.09 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -128.79 106.64 18.51 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 126.345 1.858 . . . . 0.0 108.452 156.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.15 -172.3 1.41 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.482 3.455 . . . . 0.0 112.462 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.66 164.81 33.16 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.351 0.977 . . . . 0.0 113.011 167.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 24.9 mm -64.19 -38.17 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 121.753 -0.851 . . . . 0.0 111.636 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.26 -28.07 68.91 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.823 0.849 . . . . 0.0 112.936 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 24.6 mm -79.53 -37.93 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.474 1.51 . . . . 0.0 110.413 175.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.5 mt -61.44 -49.96 74.72 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.134 168.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.08 -46.65 78.95 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.287 1.435 . . . . 0.0 113.38 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.04 -38.4 90.74 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -65.98 -46.92 76.29 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.652 -0.655 . . . . 0.0 111.311 170.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.05 -47.81 77.21 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.759 1.223 . . . . 0.0 111.951 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -52.41 -69.48 0.11 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 0.0 111.561 167.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -66.85 -18.87 65.59 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -166.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.0 mt -102.34 -2.89 28.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.294 1.438 . . . . 0.0 113.455 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 45.74 62.18 2.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.169 2.187 . . . . 0.0 112.31 -169.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.6 mt -144.41 114.27 7.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.613 1.965 . . . . 0.0 109.029 179.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 pm0 -60.37 150.67 30.02 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.353 0.979 . . . . 0.0 113.233 -174.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.8 -33.61 49.77 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 124.629 1.172 . . . . 0.0 113.578 -171.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -55.89 -48.83 74.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.728 1.611 . . . . 0.0 112.057 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -62.9 -44.79 95.16 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.482 -1.386 . . . . 0.0 111.706 175.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 34.6 mm -67.29 -35.16 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.659 0.663 . . . . 0.0 111.673 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -57.7 -57.92 10.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.22 1.408 . . . . 0.0 111.41 168.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.0 -32.33 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.435 1.016 . . . . 0.0 111.627 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -63.07 -56.15 19.37 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.459 -1.4 . . . . 0.0 112.196 171.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -58.62 -42.36 88.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.983 0.81 . . . . 0.0 111.962 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -53.85 -55.24 28.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.219 1.407 . . . . 0.0 111.055 171.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -73.98 10.9 1.02 Allowed 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.74 -61.03 1.45 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.577 1.951 . . . . 0.0 110.141 159.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -45.31 89.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.952 1.301 . . . . 0.0 112.744 -178.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.52 64.9 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.346 0.658 . . . . 0.0 112.578 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -65.65 -51.92 55.75 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.2 -0.938 . . . . 0.0 110.922 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.2 mp -59.75 -26.9 66.05 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -60.67 -61.63 2.45 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 111.575 168.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.3 ttp85 -78.91 -13.4 59.82 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.5 t -66.92 169.59 7.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.229 1.412 . . . . 0.0 112.229 176.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -138.67 133.75 32.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 0.0 110.031 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.35 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.486 1.914 . . . . 0.0 111.949 -161.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -136.85 69.57 1.41 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.903 1.681 . . . . 0.0 108.487 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.8 p -81.41 55.26 2.55 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.208 -1.558 . . . . 0.0 113.272 -176.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.43 177.74 3.82 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.761 1.624 . . . . 0.0 112.424 168.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -135.32 168.87 18.39 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.911 1.284 . . . . 0.0 111.205 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.8 5.34 5.03 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.883 1.809 . . . . 0.0 115.883 -162.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 20.8 mmt . . . . . 0 C--O 1.247 0.931 0 C-N-CA 125.813 1.645 . . . . 0.0 111.384 173.511 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.274 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 83.1 mtm-85 -146.79 -55.97 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.826 2.05 . . . . 0.0 113.034 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 148.87 97.36 Favored Pre-proline 0 N--CA 1.476 0.845 0 C-N-CA 124.523 1.129 . . . . 0.0 111.817 -173.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.49 115.11 3.18 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.94 1.76 . . . . 0.0 109.915 158.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.04 147.38 16.42 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.206 -0.934 . . . . 0.0 112.632 166.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 m -143.56 -20.62 0.6 Allowed 'General case' 0 N--CA 1.474 0.758 0 O-C-N 124.749 1.281 . . . . 0.0 112.949 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.66 93.65 0.73 Allowed 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.259 -1.526 . . . . 0.0 110.712 160.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -68.36 -166.75 0.07 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.151 2.98 . . . . 0.0 112.666 177.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -72.62 147.19 46.04 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.089 -1.007 . . . . 0.0 111.282 163.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -57.01 -36.87 70.93 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.61 -9.06 23.67 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.21 -46.12 6.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.405 1.882 . . . . 0.0 111.656 162.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mm -52.68 -43.25 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.171 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -60.25 -36.81 78.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.69 1.196 . . . . 0.0 113.276 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -48.15 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.16 0.891 . . . . 0.0 110.003 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.02 -46.19 90.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.599 1.159 . . . . 0.0 111.839 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.58 -41.67 97.74 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.697 1.199 . . . . 0.0 113.318 171.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.8 -42.28 79.25 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.845 1.657 . . . . 0.0 113.347 172.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.13 -50.22 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.411 1.005 . . . . 0.0 111.006 172.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -57.79 -33.93 69.07 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.798 1.639 . . . . 0.0 113.912 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -55.6 -52.45 63.75 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.213 2.205 . . . . 0.0 110.713 173.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.6 t -72.02 -42.28 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.474 1.51 . . . . 0.0 112.151 178.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -146.16 110.96 5.22 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.688 1.195 . . . . 0.0 112.887 -176.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 82.6 m -57.49 -24.66 57.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.333 1.453 . . . . 0.0 114.779 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -134.5 92.05 20.92 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.933 1.293 . . . . 0.0 112.237 -174.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -70.16 178.07 5.21 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.587 2.858 . . . . 0.0 113.471 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.4 -178.69 21.27 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 126.177 1.846 . . . . 0.0 112.628 169.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.32 -51.68 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.711 0.804 . . . . 0.0 111.414 -173.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -29.89 71.06 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.592 1.157 . . . . 0.0 112.305 -176.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.7 mt -71.74 -43.81 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.751 0.82 . . . . 0.0 109.555 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.21 -43.94 96.72 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.605 -0.684 . . . . 0.0 111.952 172.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.23 -35.87 80.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.654 1.181 . . . . 0.0 113.901 174.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -61.98 -47.3 85.42 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.117 1.326 . . . . 0.0 111.728 169.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.22 -48.44 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.669 0.787 . . . . 0.0 111.243 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.82 -56.03 21.25 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.451 1.1 . . . . 0.0 111.734 172.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -53.76 -23.73 12.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.203 1.801 . . . . 0.0 113.623 176.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -107.69 -2.7 19.88 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.976 1.71 . . . . 0.0 115.289 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.1 mt -134.5 -13.52 2.3 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -173.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.1 29.22 4.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.505 1.922 . . . . 0.0 114.853 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.3 mt -95.9 166.84 11.59 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.597 1.559 . . . . 0.0 110.985 160.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.07 153.47 21.24 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.428 1.108 . . . . 0.0 112.877 159.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 tt -51.03 -39.1 55.08 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.237 1.415 . . . . 0.0 113.462 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.03 -41.08 77.95 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.538 1.517 . . . . 0.0 112.834 175.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.99 -30.03 61.06 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.773 -1.204 . . . . 0.0 111.667 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 36.5 mt -73.88 -39.35 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.513 0.725 . . . . 0.0 111.588 169.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -51.68 -56.82 11.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.816 1.247 . . . . 0.0 111.292 167.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.6 mt -58.61 -34.72 52.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.709 0.804 . . . . 0.0 112.056 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.41 ' CZ2' ' HG3' ' A' ' 52' ' ' ARG . 79.1 t90 -61.92 -57.68 10.83 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.366 1.439 . . . . 0.0 110.953 171.411 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -58.68 -42.81 89.39 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -55.26 -53.06 60.87 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.338 1.055 . . . . 0.0 111.626 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -61.97 -48.38 80.63 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.949 1.25 . . . . 0.0 111.689 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG3' ' CZ2' ' A' ' 48' ' ' TRP . 2.8 mmt85 -65.68 -35.38 80.61 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.206 -0.934 . . . . 0.0 113.309 -177.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -43.24 67.4 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.106 1.321 . . . . 0.0 111.753 170.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.13 67.61 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.9 pttt -124.66 26.18 7.27 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.389 1.476 . . . . 0.0 113.043 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.0 tp -33.51 -47.19 0.21 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.132 2.573 . . . . 0.0 115.836 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -96.25 -9.73 29.64 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.289 1.588 . . . . 0.0 115.289 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -122.83 114.86 21.06 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 120.372 1.442 . . . . 0.0 113.299 -175.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 34.2 t -158.08 -175.13 5.18 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.0 1.32 . . . . 0.0 111.527 -171.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -58.37 -23.68 57.67 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 120.7 -1.25 . . . . 0.0 112.652 163.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 28.54 92.88 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.795 1 C-N-CA 131.857 4.063 . . . . 0.0 114.896 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -126.1 -11.94 6.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.674 1.99 . . . . 0.0 113.307 -167.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.6 t -140.61 174.07 10.88 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.18 0.991 . . . . 0.0 113.254 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -136.25 153.03 51.32 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.726 2.81 . . . . 0.0 110.245 -170.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -139.09 166.46 24.46 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -159.27 0.91 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.577 2.351 . . . . 0.0 111.773 -174.199 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 58.5 ttm . . . . . 0 C--O 1.252 1.197 0 C-N-CA 125.631 1.572 . . . . 0.0 110.852 177.714 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -62.01 -15.36 43.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 -161.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.6 ttp-105 -137.21 61.17 31.77 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-N 121.453 1.933 . . . . 0.0 114.051 -174.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.35 130.51 21.29 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 122.801 2.334 . . . . 0.0 112.153 -175.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -79.64 57.31 2.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.25 1.42 . . . . 0.0 111.494 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.0 m -70.08 76.83 0.5 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.585 1.554 . . . . 0.0 113.913 -168.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -85.19 172.38 11.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.654 1.181 . . . . 0.0 111.731 161.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.513 ' H ' HD11 ' A' ' 13' ' ' ILE . 5.9 m-85 -133.59 -174.3 3.48 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.535 2.734 . . . . 0.0 110.534 176.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.6 t -73.46 145.92 45.36 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.555 1.142 . . . . 0.0 111.504 168.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -55.82 -37.39 68.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.567 1.076 . . . . 0.0 113.717 -172.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -27.98 65.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 120.447 1.476 . . . . 0.0 112.719 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -82.22 -49.8 9.71 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.819 1.247 . . . . 0.0 111.041 169.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.513 HD11 ' H ' ' A' ' 8' ' ' PHE . 20.4 mm -49.93 -46.56 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 118.064 -0.97 . . . . 0.0 112.447 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.56 -27.88 66.63 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.579 1.081 . . . . 0.0 113.147 -177.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.58 -50.89 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.8 1.182 . . . . 0.0 110.364 171.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.5 -43.75 93.13 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -56.67 -41.35 77.12 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.394 1.452 . . . . 0.0 111.671 170.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -58.12 -38.34 76.31 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.452 1.024 . . . . 0.0 113.661 172.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.96 -45.38 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.177 0.899 . . . . 0.0 111.356 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -59.12 -30.1 67.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.502 1.121 . . . . 0.0 113.953 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.7 mtp85 -57.04 -54.94 41.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.543 1.137 . . . . 0.0 112.205 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.5 m -79.5 -31.62 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -131.62 85.54 2.26 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.335 2.254 . . . . 0.0 111.229 -176.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -60.0 -30.72 69.32 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -129.63 102.83 17.88 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 126.591 1.957 . . . . 0.0 108.106 164.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -78.96 -175.93 3.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.914 3.076 . . . . 0.0 112.917 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.9 167.68 18.65 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 126.111 1.815 . . . . 0.0 113.201 167.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.4 mm -64.82 -35.52 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.498 1.119 . . . . 0.0 112.568 -171.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -64.73 -32.32 73.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.139 0.975 . . . . 0.0 112.881 176.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 mm -71.72 -37.48 62.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.863 0.865 . . . . 0.0 110.563 172.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 89.9 mt -67.14 -47.68 70.36 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.75 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.63 -53.65 44.13 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 120.02 1.282 . . . . 0.0 113.399 167.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.95 -42.88 80.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.894 1.679 . . . . 0.0 112.61 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.71 -44.97 95.95 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.114 -0.991 . . . . 0.0 112.689 172.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.44 -58.67 6.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.318 1.047 . . . . 0.0 111.395 173.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -53.9 -44.18 70.3 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.11 1.364 . . . . 0.0 112.928 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -86.05 -6.58 59.0 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.2 mt -121.93 2.95 9.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.045 1.338 . . . . 0.0 113.45 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 t30 61.0 24.38 14.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.049 2.139 . . . . 0.0 114.039 -177.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.7 mt -95.85 173.09 7.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.345 2.258 . . . . 0.0 109.868 174.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -111.06 162.48 14.84 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.284 1.033 . . . . 0.0 113.337 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.6 tp -48.06 -48.07 33.47 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.504 1.522 . . . . 0.0 112.522 -176.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -60.49 -39.72 88.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.379 1.072 . . . . 0.0 112.319 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -61.93 -40.68 96.33 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.885 1.22 . . . . 0.0 111.102 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -40.41 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 118.693 0.679 . . . . 0.0 111.23 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.83 -55.62 24.94 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.268 1.027 . . . . 0.0 112.23 169.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.81 -39.25 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.411 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -60.66 -50.51 73.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.824 1.647 . . . . 0.0 111.797 175.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -65.65 -41.34 92.68 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.942 0.792 . . . . 0.0 111.769 178.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -60.4 -40.13 89.84 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.955 1.252 . . . . 0.0 111.997 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.84 -52.01 66.79 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.799 1.181 . . . . 0.0 111.702 169.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -44.86 94.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -35.11 73.02 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.784 -1.198 . . . . 0.0 111.709 175.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.98 91.84 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.704 1.138 . . . . 0.0 111.92 168.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -49.11 -29.09 4.81 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 126.897 2.079 . . . . 0.0 114.667 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.1 mp -68.81 -21.85 64.29 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -143.03 2.94 1.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -148.15 158.59 44.16 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.013 2.125 . . . . 0.0 109.24 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.4 m 62.16 -171.94 0.16 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.65 1.18 . . . . 0.0 112.756 -165.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 53.7 -159.23 0.15 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.744 1.618 . . . . 0.0 112.658 -165.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.41 77.53 1.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.141 1.776 . . . . 0.0 110.537 -178.447 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.71 72.89 9.43 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 122.246 1.022 . . . . 0.0 110.725 -171.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.3 m -149.56 175.28 11.66 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.317 1.847 . . . . 0.0 111.575 -177.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -72.4 89.36 1.24 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.135 0.974 . . . . 0.0 111.029 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -60.8 -19.34 59.36 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.63 96.86 0.19 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.966 0.803 . . . . 0.0 109.686 172.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.3 ttt . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.607 2.363 . . . . 0.0 111.161 -179.093 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.655 0 CA-C-O 118.606 -1.108 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -156.13 139.92 16.15 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.206 1.403 . . . . 0.0 110.546 172.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -119.59 53.41 2.41 Favored Pre-proline 0 N--CA 1.488 1.456 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -76.23 -177.84 3.98 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.21 2.607 . . . . 0.0 112.593 169.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.28 125.3 49.82 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.818 2.047 . . . . 0.0 109.108 174.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.5 m -136.15 138.66 42.2 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.437 0.695 . . . . 0.0 112.02 -170.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -150.21 174.89 12.3 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.096 2.158 . . . . 0.0 110.83 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -131.47 -163.36 1.32 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.405 2.282 . . . . 0.0 111.474 -167.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.6 t -73.16 150.88 41.8 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.701 0.8 . . . . 0.0 111.197 155.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.31 -33.27 74.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -167.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.91 -14.89 62.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.581 1.537 . . . . 0.0 113.198 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -78.39 -50.05 12.43 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.908 -1.12 . . . . 0.0 110.446 162.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.414 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 19.3 mm -48.34 -50.07 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.996 0.918 . . . . 0.0 112.051 175.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -60.6 -25.4 66.21 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.6 t -69.1 -43.42 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 120.078 1.308 . . . . 0.0 110.662 172.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 mp -65.82 -46.58 78.08 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.431 174.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -52.9 -47.2 68.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.716 1.143 . . . . 0.0 113.482 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -64.62 -27.2 68.77 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.4 t -71.99 -44.42 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.263 0.938 . . . . 0.0 111.508 164.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -56.42 -37.11 69.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.33 1.452 . . . . 0.0 113.353 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -69.91 -0.06 6.72 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.2 t -119.05 -37.29 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.069 1.748 . . . . 0.0 111.304 173.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -130.7 88.52 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.298 2.239 . . . . 0.0 110.163 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.73 -33.1 75.1 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.94 0.896 . . . . 0.0 112.77 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -122.78 87.97 50.18 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.901 1.68 . . . . 0.0 108.956 165.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -61.58 162.21 21.93 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.699 2.266 . . . . 0.0 114.538 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.73 164.08 44.64 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.017 0.818 . . . . 0.0 112.4 162.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.95 -39.1 70.23 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.817 0 C-N-CA 124.73 1.212 . . . . 0.0 111.103 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.31 -29.38 64.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.43 1.892 . . . . 0.0 112.972 -176.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.3 mt -69.58 -45.32 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 123.669 0.788 . . . . 0.0 109.168 170.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 14.9 mt -64.0 -43.37 95.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.553 0.741 . . . . 0.0 111.134 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.21 -35.99 80.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.446 1.498 . . . . 0.0 114.244 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.32 -44.97 93.42 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.706 -1.246 . . . . 0.0 112.05 168.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.63 -47.84 83.02 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.735 0.698 . . . . 0.0 111.912 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.82 -57.81 7.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 126.019 1.727 . . . . 0.0 111.189 174.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -57.3 -44.83 84.43 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.529 0.731 . . . . 0.0 112.587 177.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -75.12 -15.85 60.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.572 1.549 . . . . 0.0 114.656 -177.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 88.8 mt -122.77 -2.82 8.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.671 1.189 . . . . 0.0 114.199 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 55.87 56.28 6.19 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.741 2.016 . . . . 0.0 112.565 -174.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 79.9 mt -131.05 156.45 45.16 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.442 2.297 . . . . 0.0 108.691 176.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -85.37 154.19 22.03 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.819 0.736 . . . . 0.0 112.574 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.35 -47.65 6.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.493 1.917 . . . . 0.0 112.658 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.1 -34.73 78.71 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -64.28 -39.22 93.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.678 2.035 . . . . 0.0 111.347 173.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -44.92 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.295 -0.86 . . . . 0.0 111.486 174.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.28 -54.26 47.5 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.579 1.081 . . . . 0.0 111.396 172.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -56.38 -42.33 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 O-C-N 120.559 -1.338 . . . . 0.0 110.739 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.421 ' CE2' ' HD2' ' A' ' 52' ' ' ARG . 81.1 t90 -57.08 -55.84 29.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 120.432 1.469 . . . . 0.0 112.492 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -61.73 -48.03 82.56 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.82 0.848 . . . . 0.0 112.606 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -59.0 -40.93 86.4 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 120.18 1.355 . . . . 0.0 111.884 174.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -62.59 -38.02 88.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.116 1.326 . . . . 0.0 111.605 172.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HD2' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -63.42 -52.71 60.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.053 0.941 . . . . 0.0 112.744 174.285 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -36.58 84.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.344 1.058 . . . . 0.0 111.71 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.43 -60.54 3.49 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.587 0.63 . . . . 0.0 111.299 164.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 0.3 OUTLIER -53.02 -44.47 67.36 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.083 1.753 . . . . 0.0 114.12 -176.643 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.12 -54.98 40.82 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.966 0.803 . . . . 0.0 110.428 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -64.21 -40.1 95.37 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 118.106 -0.95 . . . . 0.0 113.424 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 53.21 174.8 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.781 2.033 . . . . 0.0 112.87 -164.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 t -144.53 77.07 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.407 1.083 . . . . 0.0 109.234 162.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.602 ' CG ' ' H ' ' A' ' 61' ' ' ARG . 12.6 t-80 60.79 -178.14 0.11 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.844 2.458 . . . . 0.0 114.748 -164.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.602 ' H ' ' CG ' ' A' ' 60' ' ' HIS . 27.9 mtm105 54.71 -172.5 0.05 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 128.794 2.838 . . . . 0.0 112.671 -158.143 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 50.27 62.17 2.81 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.318 1.847 . . . . 0.0 113.61 -167.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.3 t -149.64 164.86 34.0 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.16 1.384 . . . . 0.0 110.36 170.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.87 132.92 43.0 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.476 0.711 . . . . 0.0 111.83 -174.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -145.29 -175.86 4.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.207 1.403 . . . . 0.0 112.369 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp 51.69 -106.36 0.26 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.84 2.056 . . . . 0.0 114.539 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 96.0 mtp . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.25 1.82 . . . . 0.0 111.797 -162.95 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.104 0 N-CA-C 109.917 -1.273 . . . . 0.0 109.917 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.7 ptt-85 -126.94 130.13 49.49 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.789 1.294 . . . . 0.0 111.452 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 56.97 168.32 0.06 OUTLIER Pre-proline 0 CA--C 1.559 1.312 0 C-N-CA 125.601 1.56 . . . . 0.0 113.732 -167.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.25 -175.41 2.7 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.585 2.857 . . . . 0.0 113.873 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 47.94 83.02 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 127.066 2.147 . . . . 0.0 113.039 172.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.6 m -73.32 129.78 38.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.951 -1.093 . . . . 0.0 110.947 169.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -139.59 167.52 21.92 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.075 1.35 . . . . 0.0 110.937 166.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -130.48 -174.83 3.46 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.451 1.501 . . . . 0.0 113.21 -169.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.6 p -79.52 151.31 30.82 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.383 2.273 . . . . 0.0 111.285 171.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -56.75 -45.24 82.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -167.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.24 -21.38 63.82 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 121.578 1.99 . . . . 0.0 113.633 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -85.12 -38.59 18.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.794 1.238 . . . . 0.0 112.133 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.432 HD12 ' HE1' ' A' ' 48' ' ' TRP . 37.7 mm -57.7 -50.95 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.748 0.819 . . . . 0.0 111.392 171.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -66.05 -19.05 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -176.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 87.7 t -78.21 -42.77 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 120.384 -1.447 . . . . 0.0 110.653 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 71.8 mt -67.96 -48.91 64.55 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.488 1.115 . . . . 0.0 112.337 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -55.9 -40.52 73.17 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.768 1.227 . . . . 0.0 112.074 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -63.22 -25.35 68.29 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 174.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.59 -45.28 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.922 1.237 . . . . 0.0 111.215 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -53.9 -41.97 68.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.624 1.102 . . . . 0.0 112.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -6.36 23.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 175.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 61.0 t -110.58 -38.16 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.739 2.016 . . . . 0.0 111.303 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -141.36 97.41 3.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.107 2.163 . . . . 0.0 109.307 172.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 16.6 p -55.48 -33.21 63.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.936 0.894 . . . . 0.0 112.755 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.96 103.65 39.57 Favored Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 125.66 1.584 . . . . 0.0 109.39 161.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.64 179.93 5.13 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 124.201 3.267 . . . . 0.0 112.791 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.68 165.14 41.96 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.586 -0.696 . . . . 0.0 111.633 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -68.13 -36.36 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.595 1.198 . . . . 0.0 110.659 177.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.99 -36.32 74.71 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 170.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -73.47 -38.72 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.65 0.659 . . . . 0.0 110.378 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.17 -46.73 85.75 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.291 -0.88 . . . . 0.0 111.867 171.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.09 -51.12 67.39 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.749 1.619 . . . . 0.0 112.833 168.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -61.15 -41.62 97.08 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.412 1.005 . . . . 0.0 112.906 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -62.89 -45.83 90.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.572 0.749 . . . . 0.0 111.537 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.86 -53.07 62.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.062 0.945 . . . . 0.0 110.865 175.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -53.49 -40.45 65.35 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.822 1.649 . . . . 0.0 113.278 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.76 -12.74 18.1 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -174.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.1 mt -99.69 -4.84 29.92 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.37 1.068 . . . . 0.0 112.634 172.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.62 55.83 6.07 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.023 1.329 . . . . 0.0 110.819 -172.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.9 mt -126.11 177.8 6.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.981 2.112 . . . . 0.0 109.333 171.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 2.9 pm0 -104.1 162.06 13.48 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.865 -1.147 . . . . 0.0 112.655 161.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.81 -50.37 7.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.861 2.064 . . . . 0.0 112.0 173.117 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -58.64 -47.63 83.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.804 1.641 . . . . 0.0 114.126 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.416 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 47.2 mtt180 -63.94 -36.8 85.16 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 120.802 -1.186 . . . . 0.0 111.587 179.108 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.34 -42.09 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 118.512 -0.756 . . . . 0.0 112.313 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -52.13 -52.11 53.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.505 1.048 . . . . 0.0 111.434 169.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -59.1 -43.59 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 117.655 -1.164 . . . . 0.0 110.714 175.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.432 ' HE1' HD12 ' A' ' 13' ' ' ILE . 76.1 t90 -57.7 -55.1 39.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.959 1.709 . . . . 0.0 112.48 173.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -59.06 -46.57 87.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.342 0.973 . . . . 0.0 111.918 -177.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -65.04 -42.11 94.58 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.444 -0.785 . . . . 0.0 112.149 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -61.21 -38.33 86.22 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.391 1.451 . . . . 0.0 112.227 171.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.407 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -58.8 -58.3 9.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.596 1.158 . . . . 0.0 112.929 173.493 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -41.33 84.16 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 119.749 1.159 . . . . 0.0 111.738 177.045 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -48.88 78.14 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.28 -44.63 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.941 1.297 . . . . 0.0 112.139 179.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.26 -28.31 69.94 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -175.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -86.16 -0.86 56.7 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 168.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 13.29 84.57 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 130.952 3.701 . . . . 0.0 114.217 -167.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 m -54.66 138.17 42.18 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.614 1.565 . . . . 0.0 112.084 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -149.65 175.14 11.82 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.868 1.667 . . . . 0.0 109.44 159.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -154.45 -177.61 6.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.975 2.11 . . . . 0.0 108.657 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -50.59 105.91 0.11 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.368 1.867 . . . . 0.0 113.932 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.9 t -147.18 169.67 18.85 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.016 1.726 . . . . 0.0 109.407 156.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -149.05 156.11 41.75 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.386 1.874 . . . . 0.0 109.836 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -79.54 -7.74 58.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 170.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.4 tp 44.77 -123.04 0.96 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.289 2.236 . . . . 0.0 111.12 -166.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.8 ptm . . . . . 0 C--O 1.251 1.166 0 C-N-CA 129.358 3.063 . . . . 0.0 108.811 176.522 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.131 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -146.1 17.42 1.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.722 1.209 . . . . 0.0 114.212 -175.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -112.87 86.55 9.03 Favored Pre-proline 0 N--CA 1.479 0.982 0 C-N-CA 125.478 1.511 . . . . 0.0 111.027 -176.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.77 72.43 4.5 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 124.084 3.19 . . . . 0.0 113.301 -169.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -100.29 137.48 38.66 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.603 1.561 . . . . 0.0 109.384 168.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 m -147.31 125.58 12.25 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.382 -0.824 . . . . 0.0 111.218 172.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.33 168.54 19.43 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.135 1.374 . . . . 0.0 110.918 168.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -127.66 -169.57 2.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.425 2.29 . . . . 0.0 110.5 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.0 t -62.65 144.39 56.32 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 121.338 -0.851 . . . . 0.0 109.938 158.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -56.05 -34.47 65.93 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.732 1.213 . . . . 0.0 112.909 176.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -70.72 -1.31 11.01 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 126.177 1.791 . . . . 0.0 113.991 173.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -104.25 -48.88 3.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.613 1.565 . . . . 0.0 110.116 159.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.5 mm -46.52 -46.06 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 124.627 1.171 . . . . 0.0 112.571 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -53.13 -38.08 62.36 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.3 t -66.22 -49.09 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 120.357 1.435 . . . . 0.0 109.985 176.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.24 -45.45 93.2 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.14 0.576 . . . . 0.0 112.55 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -61.16 -45.08 96.11 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 120.83 -1.169 . . . . 0.0 114.087 172.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -64.5 -25.82 68.16 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 120.65 1.568 . . . . 0.0 113.443 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.6 t -70.34 -53.56 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 120.254 1.388 . . . . 0.0 110.841 165.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -54.83 -30.46 57.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.91 1.284 . . . . 0.0 113.604 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -62.05 -23.12 66.29 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 128.325 2.65 . . . . 0.0 114.389 173.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.9 t -119.53 -30.26 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.91 1.684 . . . . 0.0 112.104 -173.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -142.77 96.99 3.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.317 1.447 . . . . 0.0 110.27 165.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -70.64 -8.28 50.58 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -145.77 76.2 12.88 Favored Pre-proline 0 CA--C 1.548 0.882 0 CA-C-N 119.334 0.97 . . . . 0.0 111.29 174.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -79.35 -173.38 1.85 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.108 3.205 . . . . 0.0 114.006 -170.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -94.89 173.33 31.85 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.46 1.505 . . . . 0.0 113.74 174.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.56 -41.37 92.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 C-N-CA 123.806 0.842 . . . . 0.0 111.988 -175.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.43 -36.95 72.04 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.972 0.909 . . . . 0.0 112.912 176.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.426 ' N ' HD12 ' A' ' 30' ' ' ILE . 1.7 mp -68.17 -42.15 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.106 0.866 . . . . 0.0 110.072 174.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 67.4 mt -62.55 -46.29 89.04 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 118.869 -0.586 . . . . 0.0 112.214 173.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -62.88 -43.8 97.82 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.776 1.631 . . . . 0.0 113.964 175.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.73 -35.54 81.41 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.275 1.398 . . . . 0.0 112.003 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -66.11 -50.4 64.16 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.271 -0.893 . . . . 0.0 111.89 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.45 -43.37 71.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.382 1.473 . . . . 0.0 112.252 177.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -56.29 -69.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.752 1.221 . . . . 0.0 112.016 167.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -69.08 -15.15 63.38 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -168.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.0 mt -120.71 3.48 10.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.976 1.311 . . . . 0.0 114.376 -176.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.77 71.92 0.48 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.993 2.117 . . . . 0.0 113.716 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.8 mt -141.38 165.7 26.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.95 2.1 . . . . 0.0 109.643 170.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.24 147.11 31.36 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.888 -1.133 . . . . 0.0 112.077 158.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -49.99 -35.54 24.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.989 0.916 . . . . 0.0 113.199 172.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.76 -42.2 75.11 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 112.381 174.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -74.97 -32.12 61.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.173 -0.955 . . . . 0.0 113.319 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 4.1 mm -66.72 -39.86 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.543 1.065 . . . . 0.0 111.298 168.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.81 -58.67 7.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.958 1.303 . . . . 0.0 110.716 171.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.5 mt -54.1 -38.51 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.524 1.056 . . . . 0.0 111.469 175.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.66 -59.45 5.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 120.193 1.36 . . . . 0.0 112.956 172.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -58.96 -43.39 91.3 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.139 0.882 . . . . 0.0 111.959 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -64.43 -42.87 95.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 111.644 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -62.54 -38.43 89.97 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.645 1.566 . . . . 0.0 111.713 172.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -61.54 2.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.544 1.138 . . . . 0.0 112.328 173.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -37.41 86.4 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.491 -0.766 . . . . 0.0 112.02 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.97 88.16 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.324 0.965 . . . . 0.0 112.852 172.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -70.77 -34.11 71.48 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.96 -1.087 . . . . 0.0 113.116 -177.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -50.02 -37.06 31.2 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.877 1.271 . . . . 0.0 112.713 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -74.92 -33.95 62.07 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.009 1.723 . . . . 0.0 114.453 177.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -129.83 68.26 1.44 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.664 1.986 . . . . 0.0 111.778 -175.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 34.6 t -159.94 152.8 21.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.114 1.366 . . . . 0.0 109.821 168.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.9 t60 61.37 166.43 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.778 2.431 . . . . 0.0 114.075 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -151.46 -16.11 0.2 Allowed 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 176.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.95 145.29 56.07 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.096 1.316 . . . . 0.0 111.861 168.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -127.9 91.38 3.27 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.929 0.892 . . . . 0.0 111.908 -159.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.9 91.99 0.89 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.774 1.629 . . . . 0.0 113.342 -174.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -113.33 155.27 25.46 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.883 1.673 . . . . 0.0 110.565 165.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.35 -93.16 0.16 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.441 1.096 . . . . 0.0 111.331 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 25.4 ttt . . . . . 0 C--O 1.252 1.195 0 C-N-CA 127.916 2.487 . . . . 0.0 109.436 -176.447 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 . . . . . 0 CA--C 1.541 0.629 0 CA-C-O 120.986 0.422 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.0 t -65.87 145.76 55.55 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.153 0.581 . . . . 0.0 110.268 155.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.07 -19.71 63.21 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.089 -1.007 . . . . 0.0 113.121 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.83 -14.22 62.89 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.783 1.233 . . . . 0.0 113.432 170.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -98.16 -43.14 7.12 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.78 2.032 . . . . 0.0 110.13 172.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.3 -46.49 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.093 0.957 . . . . 0.0 110.913 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.34 69.2 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.91 -46.5 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 120.022 1.283 . . . . 0.0 109.638 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.32 -45.32 91.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.458 1.103 . . . . 0.0 112.206 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -48.62 -58.74 4.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.674 1.59 . . . . 0.0 113.009 166.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -68.06 -19.26 64.86 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -174.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 71.8 t -73.75 -51.42 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.896 1.278 . . . . 0.0 111.684 162.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -53.84 -30.2 44.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.881 1.673 . . . . 0.0 113.396 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -50.18 -52.94 31.35 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.438 1.017 . . . . 0.0 112.344 167.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.69 -49.45 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 127.982 2.513 . . . . 0.0 111.148 -173.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -131.63 96.52 3.98 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 112.294 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.6 -12.19 14.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.01 -1.056 . . . . 0.0 113.773 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -146.76 103.95 3.92 Favored Pre-proline 0 CA--C 1.547 0.839 0 O-C-N 120.324 -1.485 . . . . 0.0 110.82 160.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -75.77 176.15 10.37 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.674 2.916 . . . . 0.0 113.478 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -100.78 176.93 27.68 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.65 1.595 . . . . 0.0 113.364 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.8 mm -62.5 -39.93 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -65.7 -32.85 74.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.115 0.87 . . . . 0.0 113.045 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.5 mm -71.74 -38.58 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 123.696 0.798 . . . . 0.0 110.679 172.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.31 -47.86 77.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.726 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -41.41 94.41 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.517 1.053 . . . . 0.0 113.478 170.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -56.61 -50.44 71.99 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.285 -1.509 . . . . 0.0 112.072 172.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.6 mt -61.54 -42.2 98.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.357 0.663 . . . . 0.0 112.25 174.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -53.5 57.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.674 1.19 . . . . 0.0 112.214 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -65.15 -29.85 70.72 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -81.74 -56.45 3.99 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.745 1.218 . . . . 0.0 113.747 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 89.6 mt -74.08 -10.13 59.32 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.341 1.456 . . . . 0.0 113.781 -171.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 48.4 70.27 0.47 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.409 1.884 . . . . 0.0 111.476 -159.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.9 mt -135.24 158.5 44.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.488 1.915 . . . . 0.0 108.573 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -88.02 145.68 25.87 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.266 1.426 . . . . 0.0 110.403 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.3 tt -48.49 -41.29 29.42 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -54.18 -49.22 69.81 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.183 1.393 . . . . 0.0 112.749 175.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -59.9 -40.46 88.86 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.895 -1.128 . . . . 0.0 111.969 175.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -74.95 -34.08 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 118.745 0.702 . . . . 0.0 112.446 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -57.45 -52.46 65.27 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.424 1.011 . . . . 0.0 111.786 167.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -57.8 -37.92 62.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.255 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -61.35 -58.72 7.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 120.83 1.65 . . . . 0.0 112.361 172.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -57.94 -42.06 84.1 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -70.53 -38.84 74.29 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 120.623 -1.298 . . . . 0.0 113.466 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -62.73 -32.77 73.95 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 121.02 1.736 . . . . 0.0 111.985 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.408 HH11 ' CG ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -57.37 -58.81 6.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.582 1.153 . . . . 0.0 113.074 172.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 -56.25 -50.09 72.33 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.363 0.665 . . . . 0.0 111.846 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.807 1.039 . . . . 0.0 113.807 174.031 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.2 t -67.86 140.79 56.56 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.918 1.687 . . . . 0.0 110.488 162.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.54 -32.84 65.52 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -61.96 -33.69 74.75 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.0 1.273 . . . . 0.0 113.461 175.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.09 -40.63 45.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.726 1.21 . . . . 0.0 111.403 174.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.61 -56.21 16.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.638 0 CA-C-N 118.518 0.599 . . . . 0.0 110.616 173.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.7 -10.64 57.56 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.6 t -82.25 -52.23 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.156 0.983 . . . . 0.0 110.838 161.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -57.62 -48.1 80.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.33 1.052 . . . . 0.0 112.797 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -58.31 -38.82 77.84 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.14 1.376 . . . . 0.0 112.444 171.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -60.47 -32.53 71.49 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.9 t -73.05 -50.96 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.266 0.939 . . . . 0.0 110.559 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -54.87 -28.7 52.12 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.825 1.25 . . . . 0.0 114.01 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -56.13 -63.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.328 1.851 . . . . 0.0 112.374 165.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.6 -35.14 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -141.72 106.24 4.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.22 1.408 . . . . 0.0 111.497 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -61.91 -26.25 68.06 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.898 -1.126 . . . . 0.0 113.344 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -121.77 96.4 47.18 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 127.343 2.257 . . . . 0.0 109.615 166.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -62.52 166.28 13.73 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.32 2.013 . . . . 0.0 111.78 167.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.55 165.27 54.37 Favored Glycine 0 CA--C 1.534 1.242 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 163.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.0 mm -62.07 -32.44 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 O-C-N 121.705 -0.88 . . . . 0.0 111.281 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.58 -29.25 69.83 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.873 1.669 . . . . 0.0 112.655 177.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 52.6 mt -80.5 -38.75 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 123.891 0.876 . . . . 0.0 109.655 174.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.3 mt -63.0 -43.04 99.87 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.487 -0.758 . . . . 0.0 111.649 171.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -55.64 32.28 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.497 -1.24 . . . . 0.0 112.728 164.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -55.67 -39.06 70.44 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.448 1.931 . . . . 0.0 112.889 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.84 -53.79 53.78 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.089 0.956 . . . . 0.0 111.452 170.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.07 -55.85 18.08 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.862 1.21 . . . . 0.0 112.186 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.8 mm-40 -54.91 -40.28 69.68 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.401 1.88 . . . . 0.0 111.808 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -27.13 30.91 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 178.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.9 -19.64 15.18 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 120.026 1.284 . . . . 0.0 114.048 -171.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 62.34 32.42 16.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.194 1.797 . . . . 0.0 113.764 -170.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.2 mt -90.96 171.54 9.21 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.803 150.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.04 163.67 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.333 1.063 . . . . 0.0 112.926 161.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.87 -51.74 4.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.711 2.004 . . . . 0.0 112.143 172.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -53.43 -55.36 25.84 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.202 1.801 . . . . 0.0 114.062 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.7 mtt85 -65.49 -34.41 78.22 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.202 -0.936 . . . . 0.0 111.504 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.2 mt -71.22 -41.19 74.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.033 0.833 . . . . 0.0 112.032 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -57.38 -53.44 58.08 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.155 1.343 . . . . 0.0 110.922 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.3 mt -56.06 -43.14 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.984 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -56.42 -56.56 19.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.349 1.431 . . . . 0.0 112.61 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -56.86 -48.61 77.71 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.596 0.759 . . . . 0.0 112.336 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -63.08 -44.23 96.33 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.018 -0.992 . . . . 0.0 111.181 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -62.85 -34.54 77.58 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.28 1.4 . . . . 0.0 112.78 174.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -65.45 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.837 1.255 . . . . 0.0 112.467 170.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -41.31 82.43 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 119.481 1.037 . . . . 0.0 113.298 177.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.003 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.998 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 . . . . . 0 CA--C 1.543 0.675 0 CA-C-O 122.092 0.948 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.0 t -76.31 153.65 35.71 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.188 -0.945 . . . . 0.0 111.657 161.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -53.97 -40.18 66.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 123.852 0.861 . . . . 0.0 112.787 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -63.9 -9.58 16.13 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -101.62 -38.25 8.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.297 1.839 . . . . 0.0 111.807 168.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -55.47 -51.85 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.12 0.968 . . . . 0.0 110.873 172.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -60.48 -29.85 69.32 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -176.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 64.7 t -70.56 -46.66 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 119.28 0.946 . . . . 0.0 110.652 172.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.1 mt -64.19 -46.75 82.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.624 1.17 . . . . 0.0 111.544 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -51.94 -53.27 43.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.702 . . . . 0.0 112.309 165.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -55.41 -30.21 60.01 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 178.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 92.0 t -72.54 -55.16 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 119.609 1.095 . . . . 0.0 111.039 166.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -51.84 -32.02 30.17 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.517 1.527 . . . . 0.0 113.873 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -67.04 -22.91 65.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.418 2.687 . . . . 0.0 114.662 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 m -117.52 -35.75 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.015 1.726 . . . . 0.0 113.096 174.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -114.55 78.32 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.491 1.916 . . . . 0.0 109.379 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.4 m -55.99 -20.37 16.2 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.568 1.547 . . . . 0.0 114.833 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -143.81 98.29 5.29 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.228 1.011 . . . . 0.0 109.678 165.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.91 169.54 20.12 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.45 2.1 . . . . 0.0 111.516 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.49 167.11 33.6 Favored Glycine 0 CA--C 1.532 1.121 0 O-C-N 121.762 -0.586 . . . . 0.0 112.4 169.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.27 -29.96 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 117.944 -1.027 . . . . 0.0 111.993 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -40.04 86.07 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.703 1.592 . . . . 0.0 112.963 171.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mm -69.82 -38.57 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 118.722 0.692 . . . . 0.0 110.929 173.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 79.3 mt -66.57 -45.34 79.62 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.377 -0.827 . . . . 0.0 112.55 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -52.8 -58.21 7.62 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.858 2.063 . . . . 0.0 112.458 165.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.39 -36.4 82.18 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.844 1.202 . . . . 0.0 112.877 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.1 mt -60.42 -48.09 83.28 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.649 1.113 . . . . 0.0 111.938 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.09 -56.23 23.31 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.797 1.239 . . . . 0.0 110.341 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.76 -2.78 1.93 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.557 1.943 . . . . 0.0 115.44 176.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -128.9 -18.34 3.81 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 120.753 1.615 . . . . 0.0 114.885 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -97.41 1.88 49.77 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.05 2.14 . . . . 0.0 111.987 163.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.3 t30 43.57 60.18 2.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 128.485 2.714 . . . . 0.0 113.843 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -119.39 173.76 6.77 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.691 2.796 . . . . 0.0 108.097 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 4.9 pm0 -96.73 166.62 11.56 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 120.814 -1.179 . . . . 0.0 112.637 164.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.6 tp -52.37 -47.38 66.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.419 177.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -53.46 52.75 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.063 0.847 . . . . 0.0 112.184 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.408 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 53.7 mtt180 -65.52 -30.01 70.71 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.709 1.141 . . . . 0.0 112.354 -173.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.4 mt -78.42 -39.97 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.632 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -54.35 -53.6 51.74 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 120.659 1.572 . . . . 0.0 112.627 170.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.74 -36.16 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 117.304 -1.332 . . . . 0.0 110.81 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -58.93 -61.55 2.55 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.511 1.96 . . . . 0.0 111.77 169.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -55.48 -49.9 71.29 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.087 0.858 . . . . 0.0 112.183 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -60.84 -35.39 76.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.294 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -64.26 -51.96 61.01 Favored 'General case' 0 C--N 1.347 0.5 0 CA-C-N 120.81 1.641 . . . . 0.0 111.604 171.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -58.75 -47.27 85.24 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 120.582 1.537 . . . . 0.0 111.545 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -35.12 79.35 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.94 1.296 . . . . 0.0 113.113 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.825 0 CA-C-N 119.466 1.03 . . . . 0.0 113.479 167.941 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 . . . . . 0 CA--C 1.549 0.912 0 CA-C-O 121.773 0.797 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.4 t -84.16 147.26 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.087 -1.008 . . . . 0.0 110.249 158.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -57.62 -32.25 67.04 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.67 1.123 . . . . 0.0 112.188 176.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.45 -31.5 62.0 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.461 1.504 . . . . 0.0 113.081 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -88.58 -41.51 12.63 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 126.175 1.79 . . . . 0.0 111.026 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.3 mm -51.99 -47.29 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.819 0.848 . . . . 0.0 110.849 171.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.75 -50.91 17.39 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.8 t -66.59 -41.33 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 O-C-N 121.37 -0.831 . . . . 0.0 111.002 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.07 -46.42 81.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.583 1.153 . . . . 0.0 112.361 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -66.01 -36.31 82.92 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.964 -1.085 . . . . 0.0 112.862 172.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -59.9 -32.45 70.76 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.99 -50.89 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.824 1.193 . . . . 0.0 111.358 168.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -53.3 -32.92 51.17 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.231 1.412 . . . . 0.0 113.5 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -60.03 -26.02 65.78 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.774 2.43 . . . . 0.0 114.064 173.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.7 t -108.09 -38.14 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 126.326 1.85 . . . . 0.0 111.884 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -127.53 85.21 2.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.481 1.513 . . . . 0.0 110.155 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -53.58 -33.02 53.34 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.518 1.527 . . . . 0.0 113.005 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -117.46 119.02 34.87 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 123.935 0.894 . . . . 0.0 109.426 154.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -75.74 172.01 17.1 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.392 2.728 . . . . 0.0 111.693 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.79 171.37 50.92 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 123.972 0.796 . . . . 0.0 112.221 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.8 mm -64.3 -48.56 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.736 -0.861 . . . . 0.0 110.307 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.58 -28.92 49.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.194 2.198 . . . . 0.0 113.878 173.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.7 mt -80.46 -34.8 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 123.727 0.811 . . . . 0.0 110.605 175.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -67.23 -45.59 76.32 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.868 0.867 . . . . 0.0 111.746 169.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.03 -54.99 36.02 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.093 1.757 . . . . 0.0 112.354 169.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -59.66 -43.59 93.88 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.282 0.946 . . . . 0.0 111.781 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.9 mt -62.41 -42.88 99.77 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 120.964 -1.085 . . . . 0.0 112.728 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.05 -58.63 7.57 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.225 0.921 . . . . 0.0 110.884 173.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -61.39 -32.86 72.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.8 1.24 . . . . 0.0 113.59 -176.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.7 tttp -90.46 -45.02 9.23 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.751 1.221 . . . . 0.0 113.524 -173.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.77 -12.0 60.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.325 1.05 . . . . 0.0 113.061 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 80.99 60.28 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.328 2.651 . . . . 0.0 110.488 171.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.3 mt -136.75 -164.48 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.785 2.834 . . . . 0.0 109.231 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.15 149.05 51.03 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.877 1.271 . . . . 0.0 110.691 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.56 -38.14 66.29 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.71 1.204 . . . . 0.0 113.452 -169.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -55.87 -42.01 75.24 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.598 1.09 . . . . 0.0 112.865 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -67.67 -37.62 82.61 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.114 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.4 mm -72.02 -38.59 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 118.606 0.639 . . . . 0.0 111.854 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.65 -57.5 12.13 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.17 1.388 . . . . 0.0 111.393 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.5 mt -57.38 -41.91 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.751 0.705 . . . . 0.0 110.826 175.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -59.59 -55.22 37.23 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.516 1.053 . . . . 0.0 112.858 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -62.75 -44.83 95.19 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.339 0.972 . . . . 0.0 111.135 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.79 -44.52 86.35 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.424 1.011 . . . . 0.0 111.59 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -60.34 -49.7 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.773 1.169 . . . . 0.0 112.194 173.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -58.07 9.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.136 0.974 . . . . 0.0 112.43 176.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -38.27 87.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.702 1.601 . . . . 0.0 111.867 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.625 0 CA-C-N 120.012 1.278 . . . . 0.0 112.165 171.789 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 CA--C 1.55 0.963 0 CA-C-O 122.309 1.052 . . . . 0.0 113.224 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -66.46 147.05 53.84 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.725 0.81 . . . . 0.0 110.41 158.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -52.09 -34.99 46.47 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.788 0.835 . . . . 0.0 112.717 172.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.13 -11.48 60.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -89.71 -44.69 9.84 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.338 1.855 . . . . 0.0 110.407 166.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.8 mm -54.69 -42.35 60.73 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 C-N-CA 125.4 1.48 . . . . 0.0 110.765 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -50.42 -47.45 56.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 173.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -67.61 -43.07 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.653 1.115 . . . . 0.0 110.081 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.87 -43.38 88.52 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.263 1.025 . . . . 0.0 112.213 -179.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.448 ' CD ' HH12 ' A' ' 52' ' ' ARG . 24.2 mt-10 -63.45 -43.36 97.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.724 1.147 . . . . 0.0 113.006 170.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -59.4 -36.5 75.94 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.8 t -71.45 -45.55 68.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 120.227 1.376 . . . . 0.0 111.483 171.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -54.3 -34.34 60.74 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.078 0.951 . . . . 0.0 113.047 176.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -54.02 -39.23 65.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.738 2.015 . . . . 0.0 113.733 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.91 -45.98 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.594 1.558 . . . . 0.0 110.821 174.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -130.17 88.45 2.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.8 1.64 . . . . 0.0 111.498 -168.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.9 m -58.01 -21.49 45.15 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -153.24 88.37 3.77 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.275 1.83 . . . . 0.0 108.58 172.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.96 177.91 8.16 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.52 2.813 . . . . 0.0 112.78 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.07 164.84 54.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.657 0.646 . . . . 0.0 113.744 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 27.3 mm -62.07 -43.38 97.63 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 O-C-N 121.97 -0.724 . . . . 0.0 112.311 -171.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.42 -23.73 64.61 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.389 0.995 . . . . 0.0 113.175 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 22.8 mm -81.71 -40.61 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.674 1.59 . . . . 0.0 110.173 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.67 -49.82 71.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.07 0.948 . . . . 0.0 111.624 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.98 -39.24 85.02 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 169.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.04 -48.46 67.6 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 120.799 1.636 . . . . 0.0 112.702 170.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.2 mt -67.69 -40.08 84.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.83 0.852 . . . . 0.0 112.12 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.63 -55.92 21.66 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.608 1.163 . . . . 0.0 110.992 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -62.9 -51.74 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.753 -0.592 . . . . 0.0 111.954 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -72.43 -8.35 54.58 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.6 mt -120.87 4.63 10.49 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.026 1.33 . . . . 0.0 112.382 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.8 t30 37.23 75.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.425 2.69 . . . . 0.0 112.684 -165.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.5 mt -135.89 164.78 27.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.039 2.536 . . . . 0.0 107.79 169.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -87.91 155.24 19.95 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 120.704 -1.248 . . . . 0.0 112.184 166.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -45.01 -49.91 11.03 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.38 1.872 . . . . 0.0 111.646 175.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.08 -39.13 77.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.643 1.177 . . . . 0.0 113.839 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.95 -43.22 79.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.749 -1.22 . . . . 0.0 111.141 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.5 mm -66.14 -42.01 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.621 0.646 . . . . 0.0 111.026 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -56.5 -52.09 66.05 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.318 0.963 . . . . 0.0 112.123 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -59.25 -37.68 70.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.25 -0.906 . . . . 0.0 111.58 173.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -60.66 -59.93 4.6 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 120.514 1.506 . . . . 0.0 112.267 171.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -55.17 -47.42 75.19 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.975 0.51 . . . . 0.0 111.59 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -62.66 -39.45 93.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 116.831 -1.557 . . . . 0.0 112.856 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -60.65 -40.04 90.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 121.427 1.921 . . . . 0.0 111.443 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.448 HH12 ' CD ' ' A' ' 17' ' ' GLU . 12.4 mmt85 -66.22 -55.46 16.08 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER -69.04 -18.4 64.01 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 177.809 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 CA-C-N 119.745 1.157 . . . . 0.0 111.368 162.311 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.538 0.516 0 N-CA-C 110.601 -0.148 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.6 t -57.07 145.96 29.03 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.634 -0.667 . . . . 0.0 111.042 162.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -58.81 -24.08 61.36 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.38 -41.16 96.66 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.372 0.987 . . . . 0.0 113.398 169.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -79.92 -30.68 40.08 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.156 0.982 . . . . 0.0 111.816 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mm -62.36 -49.14 85.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.478 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.281 168.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.26 -31.06 71.58 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.296 1.407 . . . . 0.0 114.213 -176.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 75.4 t -66.12 -46.82 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.018 0.826 . . . . 0.0 110.758 170.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.4 -43.08 86.78 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.305 1.042 . . . . 0.0 112.654 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -52.99 -52.57 57.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.846 1.658 . . . . 0.0 112.135 164.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -54.43 -46.42 73.23 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.899 0.772 . . . . 0.0 112.405 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 75.7 t -58.77 -52.02 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.362 172.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -56.23 -41.36 75.56 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.681 1.582 . . . . 0.0 112.177 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -61.73 -25.47 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.119 1.767 . . . . 0.0 113.521 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.6 t -100.65 -28.33 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.942 1.697 . . . . 0.0 112.284 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -140.96 83.6 1.89 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.59 2.356 . . . . 0.0 111.147 -171.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.5 m -57.42 -25.19 59.21 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -135.24 96.81 13.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.642 1.577 . . . . 0.0 109.944 166.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.92 163.61 38.29 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.472 2.115 . . . . 0.0 111.447 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.87 169.26 50.15 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.064 0.84 . . . . 0.0 113.176 172.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 mm -61.77 -38.64 80.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.695 -0.885 . . . . 0.0 111.937 -176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -30.19 69.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.955 1.302 . . . . 0.0 112.252 177.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.0 mt -71.65 -41.31 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 119.3 0.955 . . . . 0.0 110.038 170.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.02 -46.66 88.76 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.667 -0.646 . . . . 0.0 111.845 172.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -63.21 -37.9 89.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.686 1.595 . . . . 0.0 114.294 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -68.41 -38.81 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.016 -1.052 . . . . 0.0 111.924 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.14 -45.96 86.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.445 0.698 . . . . 0.0 111.329 170.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.87 -60.14 3.52 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.867 1.267 . . . . 0.0 111.388 174.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.4 tp60 -63.21 -27.02 69.07 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -107.48 -4.62 18.27 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -108.54 -6.53 16.05 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.77 2.028 . . . . 0.0 112.13 165.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.75 60.96 3.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.665 1.586 . . . . 0.0 111.388 -170.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.4 mt -131.53 155.24 47.79 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 127.372 2.269 . . . . 0.0 109.197 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.529 ' CD ' ' HE ' ' A' ' 44' ' ' ARG . 4.8 pm0 -76.36 142.89 41.04 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 122.784 1.278 . . . . 0.0 111.066 160.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.7 tt -50.58 -35.71 31.36 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 124.958 1.303 . . . . 0.0 111.594 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.33 -51.29 46.75 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.253 1.821 . . . . 0.0 113.229 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.529 ' HE ' ' CD ' ' A' ' 41' ' ' GLU . 85.9 mtt-85 -63.67 -41.55 98.16 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.559 -0.713 . . . . 0.0 111.395 176.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 48.5 mt -70.38 -37.2 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -61.35 -51.52 68.5 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.014 1.326 . . . . 0.0 110.533 172.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.4 mt -57.78 -42.49 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 118.079 -0.962 . . . . 0.0 110.404 173.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -58.1 -62.4 1.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.285 1.402 . . . . 0.0 112.277 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -55.6 -45.28 77.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.229 0.922 . . . . 0.0 112.519 -177.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -63.92 -38.61 91.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.534 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -60.96 -46.41 90.81 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.397 1.453 . . . . 0.0 112.502 170.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.94 -50.72 72.28 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.392 0.996 . . . . 0.0 111.866 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -57.02 -43.69 82.1 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.054 0.941 . . . . 0.0 112.166 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.847 0 CA-C-N 119.102 0.864 . . . . 0.0 113.071 173.482 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 121.692 0.758 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.33 144.42 53.99 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.962 -0.461 . . . . 0.0 109.792 156.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.32 -28.45 67.99 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.362 -1.461 . . . . 0.0 113.395 -174.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -68.84 -1.81 8.07 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.93 1.455 . . . . 0.0 114.93 170.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -104.82 -38.74 6.55 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.129 1.772 . . . . 0.0 111.031 166.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mm -55.43 -53.06 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.585 0.754 . . . . 0.0 111.352 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.92 -26.82 68.47 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -176.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.8 t -66.0 -51.44 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 120.405 1.457 . . . . 0.0 109.849 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -59.0 -47.12 86.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.608 0.763 . . . . 0.0 111.504 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.09 -30.32 66.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 117.183 -1.389 . . . . 0.0 114.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -66.28 -17.21 64.61 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 121.072 1.76 . . . . 0.0 112.948 166.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.62 -52.0 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 120.266 1.394 . . . . 0.0 111.859 161.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -55.47 -31.34 61.9 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.035 . . . . 0.0 113.722 178.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -53.27 -11.94 0.35 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 131.488 3.915 . . . . 0.0 115.423 168.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 44.2 t -132.77 -54.59 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 127.3 2.24 . . . . 0.0 110.703 175.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -100.87 92.0 4.85 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.731 1.613 . . . . 0.0 111.582 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.6 m -55.2 -32.35 62.15 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 176.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -144.69 97.33 5.01 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.386 1.875 . . . . 0.0 108.682 170.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -79.37 179.85 6.02 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.371 2.714 . . . . 0.0 113.116 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.21 162.16 54.46 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.253 0.93 . . . . 0.0 113.202 169.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 mm -68.04 -29.86 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 O-C-N 121.837 -0.802 . . . . 0.0 111.311 -178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.98 -33.47 75.81 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.373 1.869 . . . . 0.0 113.335 171.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.6 mm -71.42 -41.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 119.021 0.828 . . . . 0.0 110.434 170.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.44 -41.57 96.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.864 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.26 -50.41 74.09 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.876 2.07 . . . . 0.0 113.172 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -58.45 -41.02 84.19 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.595 1.089 . . . . 0.0 112.523 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.16 -48.64 72.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.053 0.941 . . . . 0.0 112.077 170.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -48.14 69.86 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.282 1.033 . . . . 0.0 111.864 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -55.88 -60.08 3.97 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.374 1.07 . . . . 0.0 112.394 171.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -65.43 -2.39 3.22 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.2 mt -128.26 -6.33 5.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.275 1.43 . . . . 0.0 113.701 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 43.45 73.15 0.15 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.067 1.347 . . . . 0.0 110.928 -158.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.45 -173.89 3.48 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.344 1.857 . . . . 0.0 109.199 171.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -137.2 150.13 47.68 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 125.273 1.429 . . . . 0.0 110.347 -177.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.2 tp -42.39 -54.34 3.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.796 1.239 . . . . 0.0 114.328 -171.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.07 -30.24 70.86 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.55 1.068 . . . . 0.0 113.684 -178.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -71.92 -37.5 70.04 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.962 1.255 . . . . 0.0 110.643 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -46.82 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.891 0.769 . . . . 0.0 111.454 171.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -54.37 -50.48 67.4 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.482 1.037 . . . . 0.0 112.135 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -62.3 -38.9 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 120.649 -1.282 . . . . 0.0 111.511 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -57.41 -57.34 13.08 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 120.324 1.42 . . . . 0.0 111.971 170.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -56.9 -48.58 77.89 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.286 1.034 . . . . 0.0 111.553 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -61.52 -41.29 97.1 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.07 0.948 . . . . 0.0 111.909 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.87 -41.53 95.6 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 120.512 1.506 . . . . 0.0 111.951 174.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -59.99 4.07 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.47 1.108 . . . . 0.0 112.079 172.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -54.08 -49.19 69.64 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.342 1.457 . . . . 0.0 111.45 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.679 0 CA-C-N 118.906 0.775 . . . . 0.0 112.895 175.922 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -76.59 152.71 35.83 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.074 0.95 . . . . 0.0 109.982 158.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -59.81 -38.71 82.72 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.435 -1.415 . . . . 0.0 113.044 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.83 -10.35 56.34 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -90.04 -47.43 7.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.771 1.628 . . . . 0.0 110.9 163.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.424 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 22.1 mm -50.94 -47.75 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.367 1.067 . . . . 0.0 111.972 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -61.02 -23.59 65.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.1 t -68.7 -50.76 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 120.063 1.301 . . . . 0.0 110.114 169.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.8 mp -62.13 -43.68 98.3 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 176.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.72 -42.45 79.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.778 -1.201 . . . . 0.0 113.651 169.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.5 -23.71 67.09 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 173.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.4 t -77.3 -47.0 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 119.91 1.232 . . . . 0.0 111.155 165.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -61.92 -30.96 71.24 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.85 1.66 . . . . 0.0 114.225 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -59.59 -17.99 37.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.076 1.307 . . . . 0.0 113.993 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.8 t -113.22 -37.64 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 126.556 1.943 . . . . 0.0 112.076 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -111.61 91.46 3.67 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.095 1.358 . . . . 0.0 112.274 -170.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -57.18 -30.5 64.56 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.472 -0.767 . . . . 0.0 112.868 167.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -139.46 114.83 8.18 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 127.854 2.462 . . . . 0.0 108.792 158.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -76.99 179.11 6.84 Favored 'Trans proline' 0 CA--C 1.55 1.31 0 C-N-CA 122.553 2.169 . . . . 0.0 110.724 167.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.71 166.02 39.07 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.442 -0.786 . . . . 0.0 113.196 170.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.2 mm -66.46 -36.89 78.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.848 -177.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.95 -26.56 68.27 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.608 1.549 . . . . 0.0 112.643 173.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.4 mm -74.55 -37.22 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.047 -1.033 . . . . 0.0 111.055 170.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 38.1 mt -67.5 -42.19 83.25 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.481 -0.762 . . . . 0.0 112.107 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.45 -49.02 77.59 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.788 1.635 . . . . 0.0 113.055 167.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -60.1 -43.41 95.59 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.458 1.026 . . . . 0.0 112.14 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.0 -45.89 93.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.883 0.873 . . . . 0.0 112.075 171.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.36 -51.56 67.86 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.228 1.011 . . . . 0.0 111.519 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -52.94 -63.51 1.12 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.944 1.297 . . . . 0.0 112.418 170.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -69.72 -13.67 62.41 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -171.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.75 1.76 13.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.465 1.106 . . . . 0.0 112.978 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 39.09 68.29 0.37 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.53 2.332 . . . . 0.0 112.856 -162.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.7 mt -120.45 -166.68 1.35 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.385 2.274 . . . . 0.0 109.036 171.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -134.19 159.19 41.66 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.812 -1.18 . . . . 0.0 110.504 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -44.69 -55.27 5.41 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.287 1.835 . . . . 0.0 112.2 -175.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -66.06 -27.37 68.04 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -65.88 -37.7 86.82 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 121.548 1.976 . . . . 0.0 110.766 171.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -41.71 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 118.342 0.519 . . . . 0.0 111.404 174.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -57.99 -52.99 63.22 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.099 0.863 . . . . 0.0 111.747 173.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.71 -36.14 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.96 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.424 ' HE1' ' CD1' ' A' ' 13' ' ' ILE . 71.2 t90 -61.89 -60.17 4.04 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.378 1.444 . . . . 0.0 112.218 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -59.74 -43.26 94.32 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.464 0.575 . . . . 0.0 111.385 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -49.03 79.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.918 175.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -59.16 -39.67 83.21 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.858 1.663 . . . . 0.0 111.461 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -62.98 1.43 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.194 0.998 . . . . 0.0 112.694 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.27 5.1 ptm180 -63.18 -35.36 80.05 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.992 1.269 . . . . 0.0 112.985 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.832 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 176.397 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 . . . . . 0 CA--C 1.539 0.557 0 CA-C-O 121.424 0.631 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.3 t -70.86 148.7 47.53 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.026 -0.421 . . . . 0.0 110.468 164.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -49.62 -41.9 43.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.615 1.966 . . . . 0.0 113.874 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -16.59 61.48 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 120.33 1.423 . . . . 0.0 113.838 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -84.12 -40.68 17.94 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.496 1.119 . . . . 0.0 110.32 167.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 mm -54.0 -51.59 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.104 0.962 . . . . 0.0 111.586 171.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.0 -37.24 66.34 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 85.3 t -66.67 -47.63 82.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.334 1.425 . . . . 0.0 110.857 174.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.76 -43.87 95.15 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.572 1.149 . . . . 0.0 112.22 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -49.87 -55.52 14.01 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.652 1.581 . . . . 0.0 111.087 164.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 -58.27 -12.94 4.15 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.899 1.815 . . . . 0.0 115.899 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 98.9 t -86.76 -49.62 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 120.714 1.597 . . . . 0.0 111.701 161.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -54.09 -30.53 48.83 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.342 1.057 . . . . 0.0 113.78 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -53.63 -28.13 31.11 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.783 1.233 . . . . 0.0 114.038 175.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.1 t -110.2 -48.92 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.876 2.07 . . . . 0.0 111.451 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -110.62 82.83 1.66 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.798 1.239 . . . . 0.0 111.667 -175.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.3 m -54.4 -33.88 60.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.272 -0.893 . . . . 0.0 112.501 169.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -124.9 103.03 31.05 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 126.757 2.023 . . . . 0.0 108.971 167.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -81.18 176.37 8.87 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.859 3.039 . . . . 0.0 112.739 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.94 163.45 31.92 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.519 1.057 . . . . 0.0 112.876 169.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.9 mm -59.43 -38.11 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.019 1.328 . . . . 0.0 111.127 -177.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.52 -27.57 61.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.759 2.024 . . . . 0.0 112.325 -177.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 57.5 mt -76.45 -39.85 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 170.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.5 mt -62.06 -46.18 90.25 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.682 0.793 . . . . 0.0 111.344 172.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.85 -49.93 75.02 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 165.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.47 -30.35 66.91 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.22 1.827 . . . . 0.0 114.614 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -70.57 -49.76 44.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.842 0.857 . . . . 0.0 112.263 167.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.37 64.07 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.671 1.189 . . . . 0.0 112.324 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.73 -12.36 46.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.595 2.758 . . . . 0.0 114.012 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -118.74 -34.89 3.83 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.849 1.26 . . . . 0.0 113.873 -176.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.9 mt -85.95 -13.36 47.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.96 0.904 . . . . 0.0 113.058 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 67.97 65.84 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.285 2.234 . . . . 0.0 111.856 -169.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.9 mt -139.36 177.93 7.56 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.221 2.208 . . . . 0.0 109.699 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -115.46 158.85 21.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.83 1.252 . . . . 0.0 112.002 165.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.19 -41.27 68.38 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.492 1.117 . . . . 0.0 113.796 -169.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -33.74 73.66 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.478 1.035 . . . . 0.0 113.257 176.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -68.69 -39.25 80.64 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.628 -1.295 . . . . 0.0 110.546 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.61 -47.72 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.04 171.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -54.65 -49.98 69.29 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.751 1.159 . . . . 0.0 111.912 175.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.5 mt -62.5 -38.04 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 117.558 -1.211 . . . . 0.0 111.222 174.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -58.44 -58.21 9.54 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 121.029 1.74 . . . . 0.0 111.542 170.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -54.1 -51.39 64.33 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 118.91 0.777 . . . . 0.0 112.743 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.54 -40.59 83.41 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 118.21 -0.9 . . . . 0.0 112.275 174.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -62.35 -46.66 87.67 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 120.771 1.623 . . . . 0.0 112.896 174.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -61.57 -46.79 88.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 120.151 1.341 . . . . 0.0 111.529 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -47.3 85.69 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.801 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.504 0 C-N-CA 124.54 1.136 . . . . 0.0 111.623 173.64 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 . . . . . 0 CA--C 1.54 0.566 0 CA-C-O 121.457 0.646 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.2 t -66.81 147.07 53.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.265 0.626 . . . . 0.0 110.784 166.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -55.17 -35.37 64.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.42 1.088 . . . . 0.0 113.218 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -5.53 32.34 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 125.266 1.427 . . . . 0.0 114.707 175.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -109.15 -33.3 6.92 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.49 1.916 . . . . 0.0 111.143 167.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -55.27 -51.96 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.28 1.032 . . . . 0.0 111.343 167.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -57.2 -34.42 68.5 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.7 t -69.1 -39.34 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 119.952 1.251 . . . . 0.0 110.173 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.6 mt -69.13 -46.99 66.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.376 1.07 . . . . 0.0 111.495 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -58.19 -39.22 78.37 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.093 0.86 . . . . 0.0 112.523 170.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -61.91 -27.97 69.2 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.843 -1.161 . . . . 0.0 114.121 172.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.2 t -76.5 -50.77 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 119.975 1.261 . . . . 0.0 111.098 166.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.57 -34.48 71.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.571 1.148 . . . . 0.0 113.62 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -65.25 -17.81 64.8 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 174.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.9 t -98.48 -45.81 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.759 1.623 . . . . 0.0 110.77 174.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -133.25 108.03 8.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.456 1.102 . . . . 0.0 112.952 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.5 t -51.3 -39.86 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.043 1.737 . . . . 0.0 113.002 169.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.38 92.52 20.55 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 126.278 1.831 . . . . 0.0 110.533 175.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.26 176.46 10.07 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 123.185 2.59 . . . . 0.0 112.636 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.96 170.52 45.57 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.679 1.133 . . . . 0.0 114.647 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 21.8 mm -66.44 -34.89 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.716 -0.873 . . . . 0.0 111.769 -175.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.16 -29.88 70.06 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.171 1.389 . . . . 0.0 112.574 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mm -76.22 -40.82 36.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.118 0.967 . . . . 0.0 109.698 174.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.47 -47.74 82.67 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.723 -0.61 . . . . 0.0 112.06 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.72 -55.92 26.56 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.963 1.305 . . . . 0.0 112.401 168.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -62.8 -22.23 66.48 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.24 -1.538 . . . . 0.0 114.013 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -76.42 -50.04 15.17 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.016 -1.052 . . . . 0.0 112.138 164.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.4 -53.28 47.05 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.374 1.47 . . . . 0.0 111.921 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -64.17 -12.7 42.65 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.221 1.408 . . . . 0.0 114.15 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 33.3 ttmt -123.23 -47.05 2.03 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.745 1.157 . . . . 0.0 114.002 -164.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.58 -17.06 61.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.526 1.13 . . . . 0.0 112.922 168.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 71.2 74.12 0.18 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.667 2.787 . . . . 0.0 111.191 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -142.3 175.44 9.76 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.367 1.867 . . . . 0.0 109.654 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -99.27 148.96 23.6 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 121.658 -0.652 . . . . 0.0 110.324 162.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 tt -42.83 -48.13 5.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.184 1.393 . . . . 0.0 112.937 175.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.09 -41.3 87.74 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -65.16 -34.87 79.41 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.595 -1.316 . . . . 0.0 111.646 175.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.0 mt -74.6 -42.51 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 118.703 -0.665 . . . . 0.0 112.177 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -52.49 -52.65 53.35 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.249 1.42 . . . . 0.0 111.882 170.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.82 -43.66 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 123.895 0.878 . . . . 0.0 110.693 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 84.4 t90 -55.87 -53.07 61.27 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.99 1.268 . . . . 0.0 112.496 172.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -59.03 -47.48 85.07 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 118.704 0.684 . . . . 0.0 111.671 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -47.22 83.84 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.288 0.949 . . . . 0.0 111.573 176.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -63.03 -39.4 94.64 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.986 1.266 . . . . 0.0 112.515 177.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.4 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -55.98 -54.63 42.51 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.74 -1.225 . . . . 0.0 112.547 168.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -28.75 67.17 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.276 1.43 . . . . 0.0 113.718 -175.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.841 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 167.665 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 120.948 0.404 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -75.79 152.5 37.32 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.515 -0.741 . . . . 0.0 110.434 164.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.09 -25.96 64.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -72.06 -3.07 20.87 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.981 1.719 . . . . 0.0 114.573 171.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -110.08 -33.41 6.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.635 1.974 . . . . 0.0 111.405 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mm -63.04 -44.53 99.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.595 0 CA-C-O 117.649 -1.167 . . . . 0.0 111.44 170.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -54.63 -43.89 72.67 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.69 1.586 . . . . 0.0 113.763 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 39.4 t -66.87 -39.98 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.091 0.859 . . . . 0.0 110.47 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.21 -46.35 64.71 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.461 1.105 . . . . 0.0 112.403 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -64.31 -36.13 83.12 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.775 -1.203 . . . . 0.0 112.609 171.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -59.34 -46.34 88.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.659 1.118 . . . . 0.0 112.601 169.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 87.8 t -64.76 -43.25 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 121.256 -0.903 . . . . 0.0 111.241 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -54.86 -43.0 72.72 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.704 1.138 . . . . 0.0 112.63 174.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -63.9 -13.1 42.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.362 2.265 . . . . 0.0 114.525 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.35 -41.96 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.955 1.702 . . . . 0.0 111.476 169.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -143.87 104.13 4.13 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.414 2.286 . . . . 0.0 110.234 -174.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 72.0 m -57.49 -22.26 42.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -158.78 82.47 2.62 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.702 2.001 . . . . 0.0 110.181 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.41 177.9 8.04 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.335 2.69 . . . . 0.0 111.956 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.43 167.31 54.81 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 121.785 -0.572 . . . . 0.0 114.337 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.1 mm -58.3 -47.34 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.802 0 C-N-CA 124.148 0.979 . . . . 0.0 111.667 -173.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -62.59 -26.13 68.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.132 0.973 . . . . 0.0 112.767 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.3 mm -74.47 -44.86 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.654 1.182 . . . . 0.0 110.285 172.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.3 mt -63.27 -39.77 95.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.878 0.871 . . . . 0.0 111.544 173.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -74.01 -33.82 63.94 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.181 1.393 . . . . 0.0 114.458 175.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.73 -41.8 91.72 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.932 1.696 . . . . 0.0 112.158 166.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -61.78 -51.29 68.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.321 0.648 . . . . 0.0 111.402 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.74 -44.06 66.17 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.209 1.004 . . . . 0.0 112.533 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -20.48 27.95 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.644 1.977 . . . . 0.0 114.864 177.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -118.31 -36.98 3.42 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.919 1.236 . . . . 0.0 113.53 -176.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.7 mt -73.61 -9.55 58.79 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.1 1.36 . . . . 0.0 113.456 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 48.26 77.29 0.1 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.509 2.324 . . . . 0.0 112.425 -165.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.86 -179.46 5.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.085 2.554 . . . . 0.0 108.35 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -112.59 159.59 18.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.693 1.597 . . . . 0.0 111.623 164.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.63 -46.67 40.18 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.077 1.351 . . . . 0.0 111.981 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -54.95 -53.42 55.85 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.81 1.244 . . . . 0.0 113.653 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -68.0 -31.8 71.75 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.092 0.86 . . . . 0.0 111.923 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -42.28 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.378 0.99 . . . . 0.0 111.029 169.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -57.74 -54.22 49.36 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.844 1.258 . . . . 0.0 112.019 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.53 -35.69 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.199 -0.938 . . . . 0.0 111.222 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -59.46 -56.45 21.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.724 1.602 . . . . 0.0 112.369 170.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.66 -43.23 94.0 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.858 0.863 . . . . 0.0 111.991 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -55.85 -47.63 76.94 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.854 1.262 . . . . 0.0 110.284 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -74.84 3.3 8.37 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 174.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.41 -64.27 1.17 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 109.921 152.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -45.3 72.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.722 1.209 . . . . 0.0 112.951 -172.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.014 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.776 0 CA-C-O 121.158 0.504 . . . . 0.0 112.229 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.9 t -59.34 146.52 39.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 0.0 111.078 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -55.67 -36.82 67.5 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.495 -0.753 . . . . 0.0 112.981 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -16.31 45.0 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.466 1.107 . . . . 0.0 113.192 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -99.09 -46.45 5.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.006 1.722 . . . . 0.0 111.132 170.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 mm -47.85 -49.09 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.635 1.174 . . . . 0.0 111.848 174.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.95 -31.03 38.18 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.861 1.264 . . . . 0.0 113.674 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.8 t -71.66 -42.94 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 120.844 -1.16 . . . . 0.0 111.232 175.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 mp -67.23 -47.52 70.56 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.647 0.779 . . . . 0.0 111.474 175.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.19 -47.76 65.38 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.688 1.195 . . . . 0.0 111.403 170.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -55.51 -41.7 73.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.08 -47.46 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.497 1.044 . . . . 0.0 111.521 171.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -60.0 -24.01 64.13 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.861 1.664 . . . . 0.0 114.148 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -58.32 -52.3 66.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.523 1.129 . . . . 0.0 111.465 167.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.9 t -75.03 -46.7 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.701 1.6 . . . . 0.0 111.902 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -138.12 112.11 8.45 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.941 0.897 . . . . 0.0 111.455 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.7 p -72.94 -14.71 61.51 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -132.43 76.91 71.29 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.516 2.326 . . . . 0.0 110.494 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.02 159.23 54.79 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.566 2.177 . . . . 0.0 112.547 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.68 166.76 52.41 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 123.725 0.678 . . . . 0.0 112.136 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.659 HD12 ' H ' ' A' ' 28' ' ' ILE . 3.2 mp -64.12 -35.04 72.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 121.803 -0.822 . . . . 0.0 110.698 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.53 -23.96 63.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.975 1.31 . . . . 0.0 113.143 175.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.8 mt -82.89 -37.44 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.152 0.981 . . . . 0.0 109.721 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 39.4 mt -63.06 -47.88 81.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.874 0.869 . . . . 0.0 111.041 167.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -64.72 -35.75 82.06 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 172.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -53.67 -51.89 61.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.946 1.703 . . . . 0.0 110.982 166.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -57.9 -45.7 86.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 173.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.82 -53.22 59.32 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.999 0.818 . . . . 0.0 112.163 175.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -69.8 -27.84 65.23 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.9 1.28 . . . . 0.0 113.553 -174.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -92.94 -24.21 18.48 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.117 1.326 . . . . 0.0 114.455 177.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.2 mt -93.83 -17.38 23.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.28 66.14 0.64 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.454 1.901 . . . . 0.0 111.759 -166.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.46 -175.62 3.64 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.533 2.333 . . . . 0.0 108.953 167.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 pm0 -119.07 153.39 34.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.091 1.756 . . . . 0.0 111.776 169.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.27 -46.48 35.89 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.329 1.852 . . . . 0.0 112.292 -173.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -51.64 -43.77 62.74 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.53 1.532 . . . . 0.0 114.469 175.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -66.61 -41.6 88.16 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.291 -0.88 . . . . 0.0 111.086 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -38.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 118.235 0.47 . . . . 0.0 111.422 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -60.77 -52.5 64.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.07 1.348 . . . . 0.0 111.852 173.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.67 -43.86 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.39 -0.819 . . . . 0.0 110.597 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.441 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 66.7 t90 -58.97 -56.65 19.5 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.617 1.099 . . . . 0.0 112.249 176.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -63.81 -39.52 94.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.119 0.872 . . . . 0.0 112.675 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -62.52 -47.83 82.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.599 1.091 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -60.18 -42.19 94.5 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.797 1.18 . . . . 0.0 111.771 174.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.441 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -62.45 -52.08 64.95 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.063 0.945 . . . . 0.0 113.05 178.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -41.83 98.27 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 117.099 -1.429 . . . . 0.0 111.142 176.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.774 0 CA-C-N 119.576 1.08 . . . . 0.0 112.345 172.759 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.0 t -63.14 147.99 49.26 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.479 -0.763 . . . . 0.0 110.397 160.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -53.02 -34.14 54.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.407 172.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -26.67 64.43 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.512 1.051 . . . . 0.0 112.909 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -82.67 -53.48 5.89 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 126.175 1.79 . . . . 0.0 110.12 171.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.412 HD12 ' HE1' ' A' ' 48' ' ' TRP . 18.7 mm -53.48 -44.15 55.08 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 C-N-CA 125.101 1.36 . . . . 0.0 111.328 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -54.23 -40.9 68.12 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.805 1.184 . . . . 0.0 112.578 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.39 -46.31 90.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.452 -1.405 . . . . 0.0 110.768 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.416 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 5.3 mp -61.74 -48.89 78.66 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 174.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.21 -52.05 60.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.992 1.717 . . . . 0.0 112.669 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -71.92 -20.33 61.78 Favored 'General case' 0 CA--C 1.553 1.082 0 CA-C-N 119.098 0.863 . . . . 0.0 112.396 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.7 t -68.0 -55.3 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 119.876 1.217 . . . . 0.0 111.329 161.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -53.85 -38.92 65.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.758 1.623 . . . . 0.0 112.775 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.4 ttt85 -56.16 -24.38 40.88 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 127.102 2.161 . . . . 0.0 114.768 172.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.82 -26.36 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 126.111 1.764 . . . . 0.0 112.524 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -135.48 96.12 3.4 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.367 1.467 . . . . 0.0 111.18 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 71.6 m -64.89 -9.97 25.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.067 1.747 . . . . 0.0 114.876 -176.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -157.51 88.96 2.48 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 126.537 1.935 . . . . 0.0 109.642 169.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.37 161.24 43.12 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.798 1.665 . . . . 0.0 112.196 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.04 166.33 48.34 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.625 0.631 . . . . 0.0 113.31 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.12 -43.16 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.052 0.941 . . . . 0.0 112.148 -172.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -70.57 -20.14 62.81 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -176.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.6 mm -79.37 -38.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.52 1.128 . . . . 0.0 110.744 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.8 mt -64.52 -43.94 92.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.84 0.856 . . . . 0.0 111.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -58.64 -50.75 72.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.948 1.699 . . . . 0.0 113.208 167.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -55.09 -42.33 72.73 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.277 1.399 . . . . 0.0 112.249 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 mt -62.77 -46.82 86.24 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.506 -0.746 . . . . 0.0 112.206 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.73 -52.27 66.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.356 0.98 . . . . 0.0 111.817 177.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.36 -44.46 80.13 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.319 1.848 . . . . 0.0 112.616 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -101.89 -15.1 16.97 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -167.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.4 mt -95.31 -5.76 42.78 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.912 1.285 . . . . 0.0 113.039 171.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 53.63 71.3 0.51 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.647 1.979 . . . . 0.0 112.521 -165.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.6 mt -133.41 -178.8 5.15 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.164 2.185 . . . . 0.0 109.558 171.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.59 141.5 47.68 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.155 0.982 . . . . 0.0 110.385 173.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -46.39 -51.94 13.93 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.663 1.585 . . . . 0.0 111.9 -175.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -57.65 -41.97 82.54 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.194 0.998 . . . . 0.0 112.812 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.13 -35.33 80.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.596 -1.315 . . . . 0.0 111.758 174.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.6 mt -73.12 -38.3 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.228 0.922 . . . . 0.0 111.857 175.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -57.67 -56.19 25.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.883 1.22 . . . . 0.0 111.979 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.2 mp -59.26 -37.81 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 117.297 -1.335 . . . . 0.0 110.889 174.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.416 ' CZ3' ' HB3' ' A' ' 16' ' ' LEU . 80.7 t90 -55.58 -63.83 1.04 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.054 1.752 . . . . 0.0 111.164 170.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -55.72 -45.14 78.0 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.685 1.129 . . . . 0.0 112.354 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.96 -37.19 86.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 118.282 -0.866 . . . . 0.0 112.736 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -62.21 -46.69 87.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.178 1.354 . . . . 0.0 111.57 171.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.408 ' HG3' ' CH2' ' A' ' 48' ' ' TRP . 18.1 mmm180 -55.06 -53.76 51.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.086 0.857 . . . . 0.0 111.559 176.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -60.53 -44.85 95.62 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.706 0.802 . . . . 0.0 112.111 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 171.101 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 CA--C 1.544 0.74 0 CA-C-O 121.677 0.751 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -73.75 146.17 44.55 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.223 -0.923 . . . . 0.0 110.979 159.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -56.88 -31.59 65.0 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.656 1.183 . . . . 0.0 113.586 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -21.97 63.46 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.188 -0.945 . . . . 0.0 113.071 173.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -75.41 -54.16 7.52 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.767 1.227 . . . . 0.0 108.687 164.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.5 mm -48.64 -50.47 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.003 1.321 . . . . 0.0 112.118 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -59.36 -26.92 65.48 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -64.54 -51.97 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 122.027 2.194 . . . . 0.0 110.471 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.42 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 2.6 mm? -59.87 -46.08 90.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 112.603 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.75 -49.06 66.24 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.779 1.232 . . . . 0.0 113.07 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -65.76 -15.31 62.73 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.5 t -83.43 -50.04 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 119.277 0.944 . . . . 0.0 111.193 161.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -55.5 -38.82 69.66 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.422 . . . . 0.0 113.999 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.61 -7.5 33.47 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.5 t -119.05 -35.18 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.981 1.712 . . . . 0.0 111.727 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -139.73 93.92 2.71 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 128.585 2.754 . . . . 0.0 109.229 179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.9 p -59.0 -26.39 64.47 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -140.88 106.1 6.28 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.43 1.892 . . . . 0.0 108.87 159.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.68 -179.83 5.82 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 123.265 2.643 . . . . 0.0 111.779 174.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.86 167.8 54.35 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.001 0.81 . . . . 0.0 114.299 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.0 mm -61.65 -41.55 90.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.005 0.922 . . . . 0.0 111.669 -176.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.52 -31.0 67.5 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 125.968 1.707 . . . . 0.0 112.832 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.8 mm -76.52 -38.78 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.577 0.751 . . . . 0.0 110.365 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.17 -44.6 96.25 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.539 -0.725 . . . . 0.0 112.063 170.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -65.26 -41.38 94.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.19 1.796 . . . . 0.0 114.34 172.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.66 -43.5 93.41 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.683 1.128 . . . . 0.0 111.736 172.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.1 mt -61.25 -42.03 97.92 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.591 -1.318 . . . . 0.0 111.704 172.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.86 -58.63 7.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.236 1.014 . . . . 0.0 111.239 174.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -64.99 -37.2 86.89 Favored 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -70.41 -41.86 72.38 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.497 -1.377 . . . . 0.0 114.483 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 47.4 mt -90.85 -1.91 57.8 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.112 1.365 . . . . 0.0 112.696 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 48.64 50.51 17.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.07 2.548 . . . . 0.0 113.895 -170.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.0 mt -108.57 171.83 7.19 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.223 1.809 . . . . 0.0 110.037 170.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -93.89 140.01 30.21 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.509 1.147 . . . . 0.0 110.927 159.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -16.01 59.37 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -173.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.33 -43.7 80.92 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.735 1.614 . . . . 0.0 111.355 170.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -63.35 -38.59 91.75 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.719 -1.238 . . . . 0.0 111.491 171.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.6 mt -69.42 -41.32 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.504 175.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -53.85 -52.67 59.68 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.289 0.95 . . . . 0.0 112.387 169.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.06 -42.43 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.302 172.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.424 ' CZ2' ' HD3' ' A' ' 52' ' ' ARG . 87.1 t90 -56.81 -52.99 62.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 121.013 1.733 . . . . 0.0 112.283 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -61.8 -48.54 80.14 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 118.417 0.553 . . . . 0.0 112.239 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -55.48 -39.7 70.74 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.441 1.019 . . . . 0.0 112.136 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -61.31 -43.12 99.39 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.343 -1.473 . . . . 0.0 112.779 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HD3' ' CZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -58.25 -58.95 6.21 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.148 0.885 . . . . 0.0 111.75 171.142 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -30.23 71.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.76 0.824 . . . . 0.0 111.715 -172.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.924 . . . . 0.0 112.028 165.663 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 . . . . . 0 CA--C 1.542 0.641 0 CA-C-O 120.794 0.33 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -66.79 148.83 51.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.878 0.471 . . . . 0.0 110.701 159.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -57.49 -31.65 66.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.902 0.774 . . . . 0.0 112.158 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -14.16 60.22 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.536 HE21 HD11 ' A' ' 40' ' ' LEU . 1.8 tp60 -90.32 -43.75 10.14 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.185 1.794 . . . . 0.0 110.738 168.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.7 mm -55.38 -53.64 33.54 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 C-N-CA 125.006 1.323 . . . . 0.0 110.684 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -58.14 -32.15 67.89 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.125 1.329 . . . . 0.0 114.109 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.73 -45.18 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 120.086 1.312 . . . . 0.0 110.425 173.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.59 -48.06 76.35 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.782 1.233 . . . . 0.0 112.042 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.76 -45.21 78.13 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.964 1.705 . . . . 0.0 111.628 170.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -61.9 -27.09 68.56 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.55 -47.8 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 CA-C-N 120.082 1.31 . . . . 0.0 111.643 166.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -54.91 -32.77 61.43 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.561 1.073 . . . . 0.0 113.027 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -57.23 -25.63 59.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.061 2.545 . . . . 0.0 115.021 171.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.35 -31.03 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.173 1.389 . . . . 0.0 114.263 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -131.71 76.39 1.71 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.536 1.934 . . . . 0.0 109.423 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.1 p -59.71 -27.02 66.09 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -128.79 106.64 18.51 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 126.345 1.858 . . . . 0.0 108.452 156.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.15 -172.3 1.41 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.482 3.455 . . . . 0.0 112.462 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.66 164.81 33.16 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.351 0.977 . . . . 0.0 113.011 167.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 24.9 mm -64.19 -38.17 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 121.753 -0.851 . . . . 0.0 111.636 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.26 -28.07 68.91 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.823 0.849 . . . . 0.0 112.936 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 24.6 mm -79.53 -37.93 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.474 1.51 . . . . 0.0 110.413 175.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.5 mt -61.44 -49.96 74.72 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.134 168.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.08 -46.65 78.95 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.287 1.435 . . . . 0.0 113.38 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.04 -38.4 90.74 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -65.98 -46.92 76.29 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.652 -0.655 . . . . 0.0 111.311 170.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.05 -47.81 77.21 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.759 1.223 . . . . 0.0 111.951 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -52.41 -69.48 0.11 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 0.0 111.561 167.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -66.85 -18.87 65.59 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -166.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.0 mt -102.34 -2.89 28.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.294 1.438 . . . . 0.0 113.455 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 45.74 62.18 2.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.169 2.187 . . . . 0.0 112.31 -169.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.536 HD11 HE21 ' A' ' 12' ' ' GLN . 78.6 mt -144.41 114.27 7.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.613 1.965 . . . . 0.0 109.029 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 pm0 -60.37 150.67 30.02 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.353 0.979 . . . . 0.0 113.233 -174.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.8 -33.61 49.77 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 124.629 1.172 . . . . 0.0 113.578 -171.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -55.89 -48.83 74.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.728 1.611 . . . . 0.0 112.057 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -62.9 -44.79 95.16 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.482 -1.386 . . . . 0.0 111.706 175.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 34.6 mm -67.29 -35.16 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.659 0.663 . . . . 0.0 111.673 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -57.7 -57.92 10.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.22 1.408 . . . . 0.0 111.41 168.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.0 -32.33 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.435 1.016 . . . . 0.0 111.627 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -63.07 -56.15 19.37 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.459 -1.4 . . . . 0.0 112.196 171.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -58.62 -42.36 88.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.983 0.81 . . . . 0.0 111.962 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -53.85 -55.24 28.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.219 1.407 . . . . 0.0 111.055 171.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -73.98 10.9 1.02 Allowed 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.74 -61.03 1.45 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.577 1.951 . . . . 0.0 110.141 159.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -45.31 89.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.952 1.301 . . . . 0.0 112.744 -178.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 123.346 0.658 . . . . 0.0 112.578 174.878 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 122.387 1.089 . . . . 0.0 112.666 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -72.62 147.19 46.04 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.089 -1.007 . . . . 0.0 111.282 163.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -57.01 -36.87 70.93 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.61 -9.06 23.67 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.21 -46.12 6.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.405 1.882 . . . . 0.0 111.656 162.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mm -52.68 -43.25 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.171 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -60.25 -36.81 78.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.69 1.196 . . . . 0.0 113.276 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -48.15 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.16 0.891 . . . . 0.0 110.003 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.02 -46.19 90.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.599 1.159 . . . . 0.0 111.839 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.58 -41.67 97.74 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.697 1.199 . . . . 0.0 113.318 171.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.8 -42.28 79.25 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.845 1.657 . . . . 0.0 113.347 172.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.13 -50.22 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.411 1.005 . . . . 0.0 111.006 172.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -57.79 -33.93 69.07 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.798 1.639 . . . . 0.0 113.912 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -55.6 -52.45 63.75 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.213 2.205 . . . . 0.0 110.713 173.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.6 t -72.02 -42.28 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.474 1.51 . . . . 0.0 112.151 178.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -146.16 110.96 5.22 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.688 1.195 . . . . 0.0 112.887 -176.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 82.6 m -57.49 -24.66 57.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.333 1.453 . . . . 0.0 114.779 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -134.5 92.05 20.92 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.933 1.293 . . . . 0.0 112.237 -174.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -70.16 178.07 5.21 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.587 2.858 . . . . 0.0 113.471 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.4 -178.69 21.27 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 126.177 1.846 . . . . 0.0 112.628 169.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.32 -51.68 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.711 0.804 . . . . 0.0 111.414 -173.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -29.89 71.06 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.592 1.157 . . . . 0.0 112.305 -176.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.7 mt -71.74 -43.81 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.751 0.82 . . . . 0.0 109.555 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.21 -43.94 96.72 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.605 -0.684 . . . . 0.0 111.952 172.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.23 -35.87 80.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.654 1.181 . . . . 0.0 113.901 174.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -61.98 -47.3 85.42 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.117 1.326 . . . . 0.0 111.728 169.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.22 -48.44 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.669 0.787 . . . . 0.0 111.243 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.82 -56.03 21.25 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.451 1.1 . . . . 0.0 111.734 172.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -53.76 -23.73 12.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.203 1.801 . . . . 0.0 113.623 176.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -107.69 -2.7 19.88 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.976 1.71 . . . . 0.0 115.289 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.1 mt -134.5 -13.52 2.3 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -173.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.1 29.22 4.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.505 1.922 . . . . 0.0 114.853 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.3 mt -95.9 166.84 11.59 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.597 1.559 . . . . 0.0 110.985 160.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.07 153.47 21.24 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.428 1.108 . . . . 0.0 112.877 159.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 tt -51.03 -39.1 55.08 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.237 1.415 . . . . 0.0 113.462 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.03 -41.08 77.95 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.538 1.517 . . . . 0.0 112.834 175.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.99 -30.03 61.06 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.773 -1.204 . . . . 0.0 111.667 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 36.5 mt -73.88 -39.35 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.513 0.725 . . . . 0.0 111.588 169.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -51.68 -56.82 11.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.816 1.247 . . . . 0.0 111.292 167.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.6 mt -58.61 -34.72 52.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.709 0.804 . . . . 0.0 112.056 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.41 ' CZ2' ' HG3' ' A' ' 52' ' ' ARG . 79.1 t90 -61.92 -57.68 10.83 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.366 1.439 . . . . 0.0 110.953 171.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -58.68 -42.81 89.39 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -55.26 -53.06 60.87 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.338 1.055 . . . . 0.0 111.626 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -61.97 -48.38 80.63 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.949 1.25 . . . . 0.0 111.689 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG3' ' CZ2' ' A' ' 48' ' ' TRP . 2.8 mmt85 -65.68 -35.38 80.61 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.206 -0.934 . . . . 0.0 113.309 -177.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -43.24 67.4 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.106 1.321 . . . . 0.0 111.753 170.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.755 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 179.781 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 121.053 0.454 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.6 t -73.46 145.92 45.36 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.555 1.142 . . . . 0.0 111.504 168.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -55.82 -37.39 68.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.567 1.076 . . . . 0.0 113.717 -172.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -27.98 65.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 120.447 1.476 . . . . 0.0 112.719 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -82.22 -49.8 9.71 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.819 1.247 . . . . 0.0 111.041 169.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.4 mm -49.93 -46.56 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 118.064 -0.97 . . . . 0.0 112.447 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.56 -27.88 66.63 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.579 1.081 . . . . 0.0 113.147 -177.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.58 -50.89 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.8 1.182 . . . . 0.0 110.364 171.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.5 -43.75 93.13 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -56.67 -41.35 77.12 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.394 1.452 . . . . 0.0 111.671 170.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -58.12 -38.34 76.31 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.452 1.024 . . . . 0.0 113.661 172.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.96 -45.38 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.177 0.899 . . . . 0.0 111.356 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -59.12 -30.1 67.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.502 1.121 . . . . 0.0 113.953 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.7 mtp85 -57.04 -54.94 41.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.543 1.137 . . . . 0.0 112.205 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.5 m -79.5 -31.62 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -131.62 85.54 2.26 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.335 2.254 . . . . 0.0 111.229 -176.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -60.0 -30.72 69.32 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -129.63 102.83 17.88 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 126.591 1.957 . . . . 0.0 108.106 164.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -78.96 -175.93 3.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.914 3.076 . . . . 0.0 112.917 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.9 167.68 18.65 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 126.111 1.815 . . . . 0.0 113.201 167.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.4 mm -64.82 -35.52 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.498 1.119 . . . . 0.0 112.568 -171.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -64.73 -32.32 73.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.139 0.975 . . . . 0.0 112.881 176.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 mm -71.72 -37.48 62.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.863 0.865 . . . . 0.0 110.563 172.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 89.9 mt -67.14 -47.68 70.36 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.75 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.63 -53.65 44.13 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 120.02 1.282 . . . . 0.0 113.399 167.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.95 -42.88 80.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.894 1.679 . . . . 0.0 112.61 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.71 -44.97 95.95 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.114 -0.991 . . . . 0.0 112.689 172.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.44 -58.67 6.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.318 1.047 . . . . 0.0 111.395 173.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -53.9 -44.18 70.3 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.11 1.364 . . . . 0.0 112.928 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -86.05 -6.58 59.0 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.2 mt -121.93 2.95 9.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.045 1.338 . . . . 0.0 113.45 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 t30 61.0 24.38 14.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.049 2.139 . . . . 0.0 114.039 -177.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.7 mt -95.85 173.09 7.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.345 2.258 . . . . 0.0 109.868 174.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -111.06 162.48 14.84 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.284 1.033 . . . . 0.0 113.337 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.6 tp -48.06 -48.07 33.47 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.504 1.522 . . . . 0.0 112.522 -176.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -60.49 -39.72 88.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.379 1.072 . . . . 0.0 112.319 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -61.93 -40.68 96.33 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.885 1.22 . . . . 0.0 111.102 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -40.41 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 118.693 0.679 . . . . 0.0 111.23 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.83 -55.62 24.94 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.268 1.027 . . . . 0.0 112.23 169.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.81 -39.25 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.411 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -60.66 -50.51 73.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.824 1.647 . . . . 0.0 111.797 175.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -65.65 -41.34 92.68 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.942 0.792 . . . . 0.0 111.769 178.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -60.4 -40.13 89.84 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.955 1.252 . . . . 0.0 111.997 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.84 -52.01 66.79 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.799 1.181 . . . . 0.0 111.702 169.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -44.86 94.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -35.11 73.02 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.784 -1.198 . . . . 0.0 111.709 175.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.545 0 CA-C-N 119.704 1.138 . . . . 0.0 111.92 168.612 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 . . . . . 0 CA--C 1.546 0.797 0 CA-C-O 120.79 0.329 . . . . 0.0 111.474 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.6 t -73.16 150.88 41.8 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.701 0.8 . . . . 0.0 111.197 155.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.31 -33.27 74.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -167.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.91 -14.89 62.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.581 1.537 . . . . 0.0 113.198 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -78.39 -50.05 12.43 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.908 -1.12 . . . . 0.0 110.446 162.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.414 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 19.3 mm -48.34 -50.07 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.996 0.918 . . . . 0.0 112.051 175.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -60.6 -25.4 66.21 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.6 t -69.1 -43.42 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 120.078 1.308 . . . . 0.0 110.662 172.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 mp -65.82 -46.58 78.08 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.431 174.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -52.9 -47.2 68.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.716 1.143 . . . . 0.0 113.482 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -64.62 -27.2 68.77 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.4 t -71.99 -44.42 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.263 0.938 . . . . 0.0 111.508 164.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -56.42 -37.11 69.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.33 1.452 . . . . 0.0 113.353 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -69.91 -0.06 6.72 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.2 t -119.05 -37.29 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.069 1.748 . . . . 0.0 111.304 173.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -130.7 88.52 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.298 2.239 . . . . 0.0 110.163 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.73 -33.1 75.1 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.94 0.896 . . . . 0.0 112.77 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -122.78 87.97 50.18 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.901 1.68 . . . . 0.0 108.956 165.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -61.58 162.21 21.93 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.699 2.266 . . . . 0.0 114.538 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.73 164.08 44.64 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.017 0.818 . . . . 0.0 112.4 162.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.95 -39.1 70.23 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.817 0 C-N-CA 124.73 1.212 . . . . 0.0 111.103 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.31 -29.38 64.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.43 1.892 . . . . 0.0 112.972 -176.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.3 mt -69.58 -45.32 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 123.669 0.788 . . . . 0.0 109.168 170.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 14.9 mt -64.0 -43.37 95.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.553 0.741 . . . . 0.0 111.134 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.21 -35.99 80.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.446 1.498 . . . . 0.0 114.244 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.32 -44.97 93.42 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.706 -1.246 . . . . 0.0 112.05 168.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.63 -47.84 83.02 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.735 0.698 . . . . 0.0 111.912 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.82 -57.81 7.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 126.019 1.727 . . . . 0.0 111.189 174.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -44.83 84.43 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.529 0.731 . . . . 0.0 112.587 177.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -75.12 -15.85 60.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.572 1.549 . . . . 0.0 114.656 -177.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 88.8 mt -122.77 -2.82 8.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.671 1.189 . . . . 0.0 114.199 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 55.87 56.28 6.19 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.741 2.016 . . . . 0.0 112.565 -174.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 79.9 mt -131.05 156.45 45.16 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.442 2.297 . . . . 0.0 108.691 176.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -85.37 154.19 22.03 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.819 0.736 . . . . 0.0 112.574 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.35 -47.65 6.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.493 1.917 . . . . 0.0 112.658 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.1 -34.73 78.71 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -64.28 -39.22 93.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.678 2.035 . . . . 0.0 111.347 173.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -44.92 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.295 -0.86 . . . . 0.0 111.486 174.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.28 -54.26 47.5 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.579 1.081 . . . . 0.0 111.396 172.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -56.38 -42.33 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 O-C-N 120.559 -1.338 . . . . 0.0 110.739 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.421 ' CE2' ' HD2' ' A' ' 52' ' ' ARG . 81.1 t90 -57.08 -55.84 29.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 120.432 1.469 . . . . 0.0 112.492 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -61.73 -48.03 82.56 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.82 0.848 . . . . 0.0 112.606 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -59.0 -40.93 86.4 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 120.18 1.355 . . . . 0.0 111.884 174.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -62.59 -38.02 88.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.116 1.326 . . . . 0.0 111.605 172.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HD2' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -63.42 -52.71 60.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.053 0.941 . . . . 0.0 112.744 174.285 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -36.58 84.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.344 1.058 . . . . 0.0 111.71 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 118.587 0.63 . . . . 0.0 111.299 164.427 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 . . . . . 0 CA--C 1.539 0.558 0 CA-C-O 122.144 0.973 . . . . 0.0 113.21 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.6 p -79.52 151.31 30.82 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.383 2.273 . . . . 0.0 111.285 171.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -56.75 -45.24 82.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -167.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.24 -21.38 63.82 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 121.578 1.99 . . . . 0.0 113.633 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -85.12 -38.59 18.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.794 1.238 . . . . 0.0 112.133 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.432 HD12 ' HE1' ' A' ' 48' ' ' TRP . 37.7 mm -57.7 -50.95 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.748 0.819 . . . . 0.0 111.392 171.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -66.05 -19.05 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -176.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 87.7 t -78.21 -42.77 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 120.384 -1.447 . . . . 0.0 110.653 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 71.8 mt -67.96 -48.91 64.55 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.488 1.115 . . . . 0.0 112.337 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -55.9 -40.52 73.17 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.768 1.227 . . . . 0.0 112.074 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -63.22 -25.35 68.29 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 174.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.59 -45.28 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.922 1.237 . . . . 0.0 111.215 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -53.9 -41.97 68.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.624 1.102 . . . . 0.0 112.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -6.36 23.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 175.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 61.0 t -110.58 -38.16 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.739 2.016 . . . . 0.0 111.303 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -141.36 97.41 3.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.107 2.163 . . . . 0.0 109.307 172.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 16.6 p -55.48 -33.21 63.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.936 0.894 . . . . 0.0 112.755 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.96 103.65 39.57 Favored Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 125.66 1.584 . . . . 0.0 109.39 161.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.64 179.93 5.13 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 124.201 3.267 . . . . 0.0 112.791 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.68 165.14 41.96 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.586 -0.696 . . . . 0.0 111.633 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -68.13 -36.36 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.595 1.198 . . . . 0.0 110.659 177.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.99 -36.32 74.71 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 170.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -73.47 -38.72 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.65 0.659 . . . . 0.0 110.378 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.17 -46.73 85.75 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.291 -0.88 . . . . 0.0 111.867 171.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.09 -51.12 67.39 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.749 1.619 . . . . 0.0 112.833 168.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -61.15 -41.62 97.08 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.412 1.005 . . . . 0.0 112.906 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -62.89 -45.83 90.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.572 0.749 . . . . 0.0 111.537 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.86 -53.07 62.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.062 0.945 . . . . 0.0 110.865 175.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -53.49 -40.45 65.35 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.822 1.649 . . . . 0.0 113.278 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.76 -12.74 18.1 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -174.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.1 mt -99.69 -4.84 29.92 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.37 1.068 . . . . 0.0 112.634 172.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.62 55.83 6.07 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.023 1.329 . . . . 0.0 110.819 -172.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.9 mt -126.11 177.8 6.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.981 2.112 . . . . 0.0 109.333 171.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 2.9 pm0 -104.1 162.06 13.48 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.865 -1.147 . . . . 0.0 112.655 161.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.81 -50.37 7.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.861 2.064 . . . . 0.0 112.0 173.117 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -58.64 -47.63 83.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.804 1.641 . . . . 0.0 114.126 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.416 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 47.2 mtt180 -63.94 -36.8 85.16 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 120.802 -1.186 . . . . 0.0 111.587 179.108 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.34 -42.09 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 118.512 -0.756 . . . . 0.0 112.313 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -52.13 -52.11 53.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.505 1.048 . . . . 0.0 111.434 169.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -59.1 -43.59 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 117.655 -1.164 . . . . 0.0 110.714 175.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . 0.432 ' HE1' HD12 ' A' ' 13' ' ' ILE . 76.1 t90 -57.7 -55.1 39.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.959 1.709 . . . . 0.0 112.48 173.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -59.06 -46.57 87.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.342 0.973 . . . . 0.0 111.918 -177.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -65.04 -42.11 94.58 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.444 -0.785 . . . . 0.0 112.149 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -61.21 -38.33 86.22 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.391 1.451 . . . . 0.0 112.227 171.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.407 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -58.8 -58.3 9.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.596 1.158 . . . . 0.0 112.929 173.493 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -41.33 84.16 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 119.749 1.159 . . . . 0.0 111.738 177.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.951 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 172.398 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 . . . . . 0 CA--C 1.541 0.632 0 CA-C-O 120.991 0.424 . . . . 0.0 110.5 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.0 t -62.65 144.39 56.32 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 121.338 -0.851 . . . . 0.0 109.938 158.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -56.05 -34.47 65.93 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.732 1.213 . . . . 0.0 112.909 176.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -70.72 -1.31 11.01 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 126.177 1.791 . . . . 0.0 113.991 173.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -104.25 -48.88 3.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.613 1.565 . . . . 0.0 110.116 159.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.5 mm -46.52 -46.06 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 124.627 1.171 . . . . 0.0 112.571 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -53.13 -38.08 62.36 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.3 t -66.22 -49.09 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 120.357 1.435 . . . . 0.0 109.985 176.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.24 -45.45 93.2 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.14 0.576 . . . . 0.0 112.55 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -61.16 -45.08 96.11 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 120.83 -1.169 . . . . 0.0 114.087 172.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -64.5 -25.82 68.16 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 120.65 1.568 . . . . 0.0 113.443 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.6 t -70.34 -53.56 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 120.254 1.388 . . . . 0.0 110.841 165.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -54.83 -30.46 57.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.91 1.284 . . . . 0.0 113.604 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -62.05 -23.12 66.29 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 128.325 2.65 . . . . 0.0 114.389 173.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.9 t -119.53 -30.26 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.91 1.684 . . . . 0.0 112.104 -173.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -142.77 96.99 3.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.317 1.447 . . . . 0.0 110.27 165.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -70.64 -8.28 50.58 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -145.77 76.2 12.88 Favored Pre-proline 0 CA--C 1.548 0.882 0 CA-C-N 119.334 0.97 . . . . 0.0 111.29 174.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -79.35 -173.38 1.85 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.108 3.205 . . . . 0.0 114.006 -170.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -94.89 173.33 31.85 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.46 1.505 . . . . 0.0 113.74 174.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.56 -41.37 92.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 C-N-CA 123.806 0.842 . . . . 0.0 111.988 -175.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.43 -36.95 72.04 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.972 0.909 . . . . 0.0 112.912 176.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.426 ' N ' HD12 ' A' ' 30' ' ' ILE . 1.7 mp -68.17 -42.15 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.106 0.866 . . . . 0.0 110.072 174.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 67.4 mt -62.55 -46.29 89.04 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 118.869 -0.586 . . . . 0.0 112.214 173.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -62.88 -43.8 97.82 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.776 1.631 . . . . 0.0 113.964 175.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.73 -35.54 81.41 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.275 1.398 . . . . 0.0 112.003 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -66.11 -50.4 64.16 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.271 -0.893 . . . . 0.0 111.89 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.45 -43.37 71.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.382 1.473 . . . . 0.0 112.252 177.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -56.29 -69.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.752 1.221 . . . . 0.0 112.016 167.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -69.08 -15.15 63.38 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -168.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.0 mt -120.71 3.48 10.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.976 1.311 . . . . 0.0 114.376 -176.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.77 71.92 0.48 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.993 2.117 . . . . 0.0 113.716 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.8 mt -141.38 165.7 26.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.95 2.1 . . . . 0.0 109.643 170.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.24 147.11 31.36 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.888 -1.133 . . . . 0.0 112.077 158.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -49.99 -35.54 24.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.989 0.916 . . . . 0.0 113.199 172.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.76 -42.2 75.11 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 112.381 174.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -74.97 -32.12 61.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.173 -0.955 . . . . 0.0 113.319 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 4.1 mm -66.72 -39.86 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.543 1.065 . . . . 0.0 111.298 168.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.81 -58.67 7.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.958 1.303 . . . . 0.0 110.716 171.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.5 mt -54.1 -38.51 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.524 1.056 . . . . 0.0 111.469 175.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.66 -59.45 5.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 120.193 1.36 . . . . 0.0 112.956 172.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -58.96 -43.39 91.3 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.139 0.882 . . . . 0.0 111.959 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -64.43 -42.87 95.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 111.644 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -62.54 -38.43 89.97 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.645 1.566 . . . . 0.0 111.713 172.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -61.54 2.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.544 1.138 . . . . 0.0 112.328 173.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -37.41 86.4 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.491 -0.766 . . . . 0.0 112.02 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.705 0 CA-C-N 119.324 0.965 . . . . 0.0 112.852 172.068 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.913 0 CA-C-O 118.494 -1.17 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 12.37 66.58 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 130.937 3.695 . . . . 0.0 116.77 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 64.6 mtt-85 -71.66 146.82 91.57 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 123.907 0.883 . . . . 0.0 112.161 -172.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -71.63 179.14 4.94 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.448 2.765 . . . . 0.0 111.709 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.93 97.39 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.744 0.818 . . . . 0.0 109.669 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.8 m -75.24 145.08 42.24 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.081 1.752 . . . . 0.0 109.993 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -130.43 164.42 24.79 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.545 1.138 . . . . 0.0 111.259 173.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -131.94 -172.01 2.77 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.984 1.714 . . . . 0.0 111.233 -177.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.0 t -65.87 145.76 55.55 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.153 0.581 . . . . 0.0 110.268 155.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.07 -19.71 63.21 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.089 -1.007 . . . . 0.0 113.121 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.83 -14.22 62.89 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.783 1.233 . . . . 0.0 113.432 170.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -98.16 -43.14 7.12 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.78 2.032 . . . . 0.0 110.13 172.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.3 -46.49 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.093 0.957 . . . . 0.0 110.913 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.34 69.2 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 -177.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.91 -46.5 78.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 120.022 1.283 . . . . 0.0 109.638 171.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.32 -45.32 91.84 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.458 1.103 . . . . 0.0 112.206 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -48.62 -58.74 4.27 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.674 1.59 . . . . 0.0 113.009 166.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -68.06 -19.26 64.86 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -174.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 71.8 t -73.75 -51.42 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.896 1.278 . . . . 0.0 111.684 162.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -53.84 -30.2 44.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.881 1.673 . . . . 0.0 113.396 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 66.7 mtt-85 -50.18 -52.94 31.35 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.438 1.017 . . . . 0.0 112.344 167.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 38.5 t -72.69 -49.45 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 127.982 2.513 . . . . 0.0 111.148 -173.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -131.63 96.52 3.98 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 112.294 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m -61.6 -12.19 14.7 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.01 -1.056 . . . . 0.0 113.773 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -146.76 103.95 3.92 Favored Pre-proline 0 CA--C 1.547 0.839 0 O-C-N 120.324 -1.485 . . . . 0.0 110.82 160.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -75.77 176.15 10.37 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.674 2.916 . . . . 0.0 113.478 -176.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -100.78 176.93 27.68 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.65 1.595 . . . . 0.0 113.364 170.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.8 mm -62.5 -39.93 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -65.7 -32.85 74.64 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 119.115 0.87 . . . . 0.0 113.045 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 29.5 mm -71.74 -38.58 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 123.696 0.798 . . . . 0.0 110.679 172.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.31 -47.86 77.85 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 118.5 -0.762 . . . . 0.0 111.726 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.53 -41.41 94.41 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.517 1.053 . . . . 0.0 113.478 170.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -56.61 -50.44 71.99 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 120.285 -1.509 . . . . 0.0 112.072 172.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.6 mt -61.54 -42.2 98.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.357 0.663 . . . . 0.0 112.25 174.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -53.5 57.26 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.674 1.19 . . . . 0.0 112.214 175.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -65.15 -29.85 70.72 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -81.74 -56.45 3.99 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.745 1.218 . . . . 0.0 113.747 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 89.6 mt -74.08 -10.13 59.32 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.341 1.456 . . . . 0.0 113.781 -171.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 48.4 70.27 0.47 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.409 1.884 . . . . 0.0 111.476 -159.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.9 mt -135.24 158.5 44.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.488 1.915 . . . . 0.0 108.573 170.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 pm0 -88.02 145.68 25.87 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 125.266 1.426 . . . . 0.0 110.403 168.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.3 tt -48.49 -41.29 29.42 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -54.18 -49.22 69.81 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.183 1.393 . . . . 0.0 112.749 175.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -59.9 -40.46 88.86 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.895 -1.128 . . . . 0.0 111.969 175.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -74.95 -34.08 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 118.745 0.702 . . . . 0.0 112.446 179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -57.45 -52.46 65.27 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.424 1.011 . . . . 0.0 111.786 167.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -57.8 -37.92 62.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-O 118.287 -0.863 . . . . 0.0 111.255 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -61.35 -58.72 7.08 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 120.83 1.65 . . . . 0.0 112.361 172.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -57.94 -42.06 84.1 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -70.53 -38.84 74.29 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 120.623 -1.298 . . . . 0.0 113.466 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -62.73 -32.77 73.95 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 121.02 1.736 . . . . 0.0 111.985 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.408 HH11 ' CG ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -57.37 -58.81 6.64 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.582 1.153 . . . . 0.0 113.074 172.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 46.6 mtt-85 -56.25 -50.09 72.33 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.363 0.665 . . . . 0.0 111.846 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.12 -47.6 65.23 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 113.807 1.039 . . . . 0.0 113.807 174.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -60.54 -48.47 81.62 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 121.189 -0.944 . . . . 0.0 112.323 176.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 55.5 tp -59.35 -37.12 77.04 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.545 1.138 . . . . 0.0 113.076 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -67.45 -43.95 79.84 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.692 0.797 . . . . 0.0 112.484 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 71.82 -41.36 0.5 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 128.674 2.79 . . . . 0.0 114.997 170.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.2 p -136.07 163.04 31.25 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.609 1.964 . . . . 0.0 111.0 165.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.1 m80 64.77 173.03 0.2 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 128.138 2.575 . . . . 0.0 114.811 -177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.0 mtt180 -158.26 150.21 21.66 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.834 2.454 . . . . 0.0 110.706 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -50.72 -67.0 0.29 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.442 1.497 . . . . 0.0 113.213 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.9 t -73.49 25.71 0.07 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.48 1.512 . . . . 0.0 113.338 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -140.9 155.51 46.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.877 1.671 . . . . 0.0 111.306 -171.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -153.41 -54.44 0.11 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.288 1.835 . . . . 0.0 109.35 176.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.4 tp 58.73 -49.06 0.06 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 129.108 2.963 . . . . 0.0 114.356 -166.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 18.3 ttt . . . . . 0 C--O 1.249 1.072 0 C-N-CA 127.75 2.42 . . . . 0.0 111.895 -177.117 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 CA-C-O 119.091 -0.838 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 42.3 mtp85 -63.19 89.97 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 127.572 2.349 . . . . 0.0 111.501 178.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 33.8 ttt85 -153.54 135.53 9.08 Favored Pre-proline 0 N--CA 1.475 0.781 0 C-N-CA 124.609 1.163 . . . . 0.0 111.246 -166.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -77.3 54.28 4.61 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 C-N-CA 124.05 3.167 . . . . 0.0 114.271 -176.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.2 ttt85 -148.87 129.2 13.79 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.512 1.525 . . . . 0.0 110.415 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.5 m -112.12 -15.99 13.13 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.682 1.593 . . . . 0.0 112.28 177.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -66.05 93.83 0.21 Allowed 'General case' 0 CA--C 1.547 0.833 0 O-C-N 119.921 -1.737 . . . . 0.0 111.915 165.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -66.38 -167.38 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 129.289 3.036 . . . . 0.0 115.238 -176.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.2 t -67.86 140.79 56.56 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.918 1.687 . . . . 0.0 110.488 162.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.54 -32.84 65.52 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -61.96 -33.69 74.75 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.0 1.273 . . . . 0.0 113.461 175.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -77.09 -40.63 45.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.726 1.21 . . . . 0.0 111.403 174.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.61 -56.21 16.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.638 0 CA-C-N 118.518 0.599 . . . . 0.0 110.616 173.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -68.7 -10.64 57.56 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -175.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.6 t -82.25 -52.23 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 124.156 0.983 . . . . 0.0 110.838 161.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 82.1 mt -57.62 -48.1 80.36 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.33 1.052 . . . . 0.0 112.797 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -58.31 -38.82 77.84 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.14 1.376 . . . . 0.0 112.444 171.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -60.47 -32.53 71.49 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.9 t -73.05 -50.96 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.266 0.939 . . . . 0.0 110.559 169.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -54.87 -28.7 52.12 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.825 1.25 . . . . 0.0 114.01 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -56.13 -63.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.328 1.851 . . . . 0.0 112.374 165.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 m -72.6 -35.14 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -141.72 106.24 4.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.22 1.408 . . . . 0.0 111.497 172.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.4 p -61.91 -26.25 68.06 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.898 -1.126 . . . . 0.0 113.344 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -121.77 96.4 47.18 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 127.343 2.257 . . . . 0.0 109.615 166.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -62.52 166.28 13.73 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.32 2.013 . . . . 0.0 111.78 167.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.55 165.27 54.37 Favored Glycine 0 CA--C 1.534 1.242 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 163.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.0 mm -62.07 -32.44 54.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 O-C-N 121.705 -0.88 . . . . 0.0 111.281 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.58 -29.25 69.83 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.873 1.669 . . . . 0.0 112.655 177.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 52.6 mt -80.5 -38.75 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 123.891 0.876 . . . . 0.0 109.655 174.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.3 mt -63.0 -43.04 99.87 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.487 -0.758 . . . . 0.0 111.649 171.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.65 -55.64 32.28 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.497 -1.24 . . . . 0.0 112.728 164.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -55.67 -39.06 70.44 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.448 1.931 . . . . 0.0 112.889 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.0 mt -59.84 -53.79 53.78 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.089 0.956 . . . . 0.0 111.452 170.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.07 -55.85 18.08 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 119.862 1.21 . . . . 0.0 112.186 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.8 mm-40 -54.91 -40.28 69.68 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.401 1.88 . . . . 0.0 111.808 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.89 -27.13 30.91 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 178.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.5 mt -101.9 -19.64 15.18 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 120.026 1.284 . . . . 0.0 114.048 -171.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 62.34 32.42 16.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.194 1.797 . . . . 0.0 113.764 -170.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.2 mt -90.96 171.54 9.21 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.803 150.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -97.04 163.67 12.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.333 1.063 . . . . 0.0 112.926 161.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.87 -51.74 4.23 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.711 2.004 . . . . 0.0 112.143 172.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -53.43 -55.36 25.84 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 126.202 1.801 . . . . 0.0 114.062 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 63.7 mtt85 -65.49 -34.41 78.22 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.202 -0.936 . . . . 0.0 111.504 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 60.2 mt -71.22 -41.19 74.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 119.033 0.833 . . . . 0.0 112.032 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -57.38 -53.44 58.08 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 120.155 1.343 . . . . 0.0 110.922 173.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 92.3 mt -56.06 -43.14 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.984 174.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -56.42 -56.56 19.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.349 1.431 . . . . 0.0 112.61 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -56.86 -48.61 77.71 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.596 0.759 . . . . 0.0 112.336 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -63.08 -44.23 96.33 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.018 -0.992 . . . . 0.0 111.181 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 m-80 -62.85 -34.54 77.58 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 120.28 1.4 . . . . 0.0 112.78 174.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.7 -65.45 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.837 1.255 . . . . 0.0 112.467 170.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -41.31 82.43 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 119.481 1.037 . . . . 0.0 113.298 177.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.55 -9.61 14.09 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 173.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -130.23 7.72 5.04 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 52.9 tp -51.07 -57.54 8.4 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.534 1.516 . . . . 0.0 111.867 -177.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.82 14.04 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 172.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.5 ttt85 -139.32 17.94 2.58 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.15 1.78 . . . . 0.0 113.71 166.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -96.72 72.5 2.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.583 -1.323 . . . . 0.0 112.044 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 84.6 m-70 -70.95 50.52 0.14 Allowed 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 126.93 2.092 . . . . 0.0 114.982 -174.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -134.59 2.04 3.16 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 128.63 2.772 . . . . 0.0 112.466 172.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.545 ' HG2' ' H ' ' A' ' 64' ' ' GLN . 28.4 tt0 -72.43 159.95 33.13 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.306 -0.871 . . . . 0.0 110.712 163.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.4 m -146.67 35.49 0.95 Allowed 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.641 -1.287 . . . . 0.0 111.155 170.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.545 ' H ' ' HG2' ' A' ' 62' ' ' GLU . 15.3 tp60 -78.7 -66.85 0.81 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.907 1.283 . . . . 0.0 111.001 -177.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -148.22 -81.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.452 0.701 . . . . 0.0 112.128 173.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.4 tp -162.29 160.75 27.14 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.082 2.553 . . . . 0.0 108.161 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 8.3 ttt . . . . . 0 C--O 1.248 1.01 0 CA-C-N 119.202 0.91 . . . . 0.0 111.747 169.753 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.883 0 N-CA-C 111.066 -0.813 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.4 mtt-85 -133.73 -176.57 4.21 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.073 2.149 . . . . 0.0 112.519 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 8.83 75.49 0.06 OUTLIER Pre-proline 0 N--CA 1.491 1.62 0 C-N-CA 129.985 3.314 . . . . 0.0 115.559 -173.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -78.5 49.2 2.98 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 124.045 3.163 . . . . 0.0 113.914 -173.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -61.12 103.98 0.33 Allowed 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.646 -1.284 . . . . 0.0 110.185 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.8 m -71.27 135.58 47.52 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 121.625 -0.672 . . . . 0.0 110.989 -173.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.16 122.55 25.5 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.053 1.341 . . . . 0.0 110.5 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -94.66 -169.22 1.98 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.98 1.712 . . . . 0.0 112.398 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.0 t -76.31 153.65 35.71 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 121.188 -0.945 . . . . 0.0 111.657 161.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -53.97 -40.18 66.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 123.852 0.861 . . . . 0.0 112.787 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -63.9 -9.58 16.13 Favored 'General case' 0 CA--C 1.554 1.118 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -101.62 -38.25 8.01 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 126.297 1.839 . . . . 0.0 111.807 168.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -55.47 -51.85 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.12 0.968 . . . . 0.0 110.873 172.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -60.48 -29.85 69.32 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.783 1.031 . . . . 0.0 113.783 -176.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 64.7 t -70.56 -46.66 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-N 119.28 0.946 . . . . 0.0 110.652 172.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.1 mt -64.19 -46.75 82.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.624 1.17 . . . . 0.0 111.544 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -51.94 -53.27 43.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.954 1.702 . . . . 0.0 112.309 165.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -55.41 -30.21 60.01 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 178.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 92.0 t -72.54 -55.16 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-N 119.609 1.095 . . . . 0.0 111.039 166.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -51.84 -32.02 30.17 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.517 1.527 . . . . 0.0 113.873 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -67.04 -22.91 65.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.418 2.687 . . . . 0.0 114.662 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 4.0 m -117.52 -35.75 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 126.015 1.726 . . . . 0.0 113.096 174.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -114.55 78.32 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.491 1.916 . . . . 0.0 109.379 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.4 m -55.99 -20.37 16.2 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.568 1.547 . . . . 0.0 114.833 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -143.81 98.29 5.29 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.228 1.011 . . . . 0.0 109.678 165.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -70.91 169.54 20.12 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.45 2.1 . . . . 0.0 111.516 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.49 167.11 33.6 Favored Glycine 0 CA--C 1.532 1.121 0 O-C-N 121.762 -0.586 . . . . 0.0 112.4 169.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.27 -29.96 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.977 0 CA-C-O 117.944 -1.027 . . . . 0.0 111.993 -173.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -40.04 86.07 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 120.703 1.592 . . . . 0.0 112.963 171.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mm -69.82 -38.57 76.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 118.722 0.692 . . . . 0.0 110.929 173.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 79.3 mt -66.57 -45.34 79.62 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.377 -0.827 . . . . 0.0 112.55 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -52.8 -58.21 7.62 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.858 2.063 . . . . 0.0 112.458 165.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.39 -36.4 82.18 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.844 1.202 . . . . 0.0 112.877 -178.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 49.1 mt -60.42 -48.09 83.28 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.649 1.113 . . . . 0.0 111.938 169.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.09 -56.23 23.31 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.797 1.239 . . . . 0.0 110.341 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.76 -2.78 1.93 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.557 1.943 . . . . 0.0 115.44 176.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -128.9 -18.34 3.81 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 120.753 1.615 . . . . 0.0 114.885 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -97.41 1.88 49.77 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.05 2.14 . . . . 0.0 111.987 163.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.3 t30 43.57 60.18 2.74 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 128.485 2.714 . . . . 0.0 113.843 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -119.39 173.76 6.77 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 128.691 2.796 . . . . 0.0 108.097 169.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 4.9 pm0 -96.73 166.62 11.56 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 120.814 -1.179 . . . . 0.0 112.637 164.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 24.6 tp -52.37 -47.38 66.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.419 177.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -53.46 52.75 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.063 0.847 . . . . 0.0 112.184 177.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.408 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 53.7 mtt180 -65.52 -30.01 70.71 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.709 1.141 . . . . 0.0 112.354 -173.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.4 mt -78.42 -39.97 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.632 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -54.35 -53.6 51.74 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 120.659 1.572 . . . . 0.0 112.627 170.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.74 -36.16 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.329 0 CA-C-O 117.304 -1.332 . . . . 0.0 110.81 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -58.93 -61.55 2.55 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.511 1.96 . . . . 0.0 111.77 169.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -55.48 -49.9 71.29 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 119.087 0.858 . . . . 0.0 112.183 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -60.84 -35.39 76.45 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.294 177.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -64.26 -51.96 61.01 Favored 'General case' 0 C--N 1.347 0.5 0 CA-C-N 120.81 1.641 . . . . 0.0 111.604 171.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -58.75 -47.27 85.24 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 120.582 1.537 . . . . 0.0 111.545 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -35.12 79.35 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.94 1.296 . . . . 0.0 113.113 178.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.66 -49.31 54.88 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.466 1.03 . . . . 0.0 113.479 167.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.3 tttp -54.88 -29.3 55.23 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.385 2.274 . . . . 0.0 112.217 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.48 -51.19 70.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.322 1.449 . . . . 0.0 112.12 170.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.3 -40.16 93.14 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 119.472 1.033 . . . . 0.0 111.871 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -79.79 55.56 2.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.065 1.346 . . . . 0.0 112.145 166.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.5 p -150.09 170.37 19.06 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.792 1.237 . . . . 0.0 111.035 163.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -143.62 82.08 1.72 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -174.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -141.25 163.77 32.06 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.258 1.423 . . . . 0.0 109.664 166.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -137.55 146.72 44.43 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.207 1.803 . . . . 0.0 109.272 -178.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.1 m -109.07 139.0 44.54 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.965 0.906 . . . . 0.0 112.01 -178.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -78.99 131.26 36.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.039 0.535 . . . . 0.0 111.52 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.54 170.59 10.34 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.994 1.718 . . . . 0.0 113.324 -175.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.434 ' HG ' ' H ' ' A' ' 67' ' ' MET . 6.2 tp -137.25 179.58 6.31 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.616 1.566 . . . . 0.0 111.703 -176.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.434 ' H ' ' HG ' ' A' ' 66' ' ' LEU . 90.2 mtp . . . . . 0 C--O 1.249 1.064 0 C-N-CA 125.711 1.605 . . . . 0.0 111.743 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.836 0 N-CA-C 109.189 -1.564 . . . . 0.0 109.189 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -136.38 104.76 5.71 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.196 1.398 . . . . 0.0 109.864 166.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -41.81 131.59 2.42 Favored Pre-proline 0 N--CA 1.483 1.221 0 C-N-CA 126.344 1.858 . . . . 0.0 115.247 -161.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -67.19 119.77 6.81 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.856 2.371 . . . . 0.0 111.002 176.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 66.86 126.95 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 128.282 2.633 . . . . 0.0 112.395 -171.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.8 m -56.18 -58.29 8.59 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.58 1.552 . . . . 0.0 113.966 -172.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.31 148.49 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 129.476 3.11 . . . . 0.0 116.629 -172.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -129.21 -169.48 2.1 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.21 2.604 . . . . 0.0 110.2 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.4 t -84.16 147.26 27.41 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.087 -1.008 . . . . 0.0 110.249 158.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -57.62 -32.25 67.04 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.67 1.123 . . . . 0.0 112.188 176.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -55.45 -31.5 62.0 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.461 1.504 . . . . 0.0 113.081 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -88.58 -41.51 12.63 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 126.175 1.79 . . . . 0.0 111.026 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.3 mm -51.99 -47.29 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.819 0.848 . . . . 0.0 110.849 171.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.75 -50.91 17.39 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.103 1.52 . . . . 0.0 115.103 176.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.8 t -66.59 -41.33 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 O-C-N 121.37 -0.831 . . . . 0.0 111.002 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.07 -46.42 81.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.583 1.153 . . . . 0.0 112.361 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -66.01 -36.31 82.92 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.964 -1.085 . . . . 0.0 112.862 172.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -59.9 -32.45 70.76 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 171.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.2 t -71.99 -50.89 34.41 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.824 1.193 . . . . 0.0 111.358 168.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -53.3 -32.92 51.17 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.231 1.412 . . . . 0.0 113.5 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.8 ttt180 -60.03 -26.02 65.78 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.774 2.43 . . . . 0.0 114.064 173.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.7 t -108.09 -38.14 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 126.326 1.85 . . . . 0.0 111.884 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -127.53 85.21 2.33 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.481 1.513 . . . . 0.0 110.155 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -53.58 -33.02 53.34 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.518 1.527 . . . . 0.0 113.005 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -117.46 119.02 34.87 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 123.935 0.894 . . . . 0.0 109.426 154.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -75.74 172.01 17.1 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.392 2.728 . . . . 0.0 111.693 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.79 171.37 50.92 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 123.972 0.796 . . . . 0.0 112.221 164.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.8 mm -64.3 -48.56 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.736 -0.861 . . . . 0.0 110.307 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.58 -28.92 49.52 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.194 2.198 . . . . 0.0 113.878 173.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.7 mt -80.46 -34.8 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 123.727 0.811 . . . . 0.0 110.605 175.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -67.23 -45.59 76.32 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.868 0.867 . . . . 0.0 111.746 169.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -55.03 -54.99 36.02 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.093 1.757 . . . . 0.0 112.354 169.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -59.66 -43.59 93.88 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.282 0.946 . . . . 0.0 111.781 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.9 mt -62.41 -42.88 99.77 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 120.964 -1.085 . . . . 0.0 112.728 174.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.05 -58.63 7.57 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.225 0.921 . . . . 0.0 110.884 173.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -61.39 -32.86 72.8 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.8 1.24 . . . . 0.0 113.59 -176.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.7 tttp -90.46 -45.02 9.23 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.751 1.221 . . . . 0.0 113.524 -173.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -78.77 -12.0 60.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.325 1.05 . . . . 0.0 113.061 176.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 80.99 60.28 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 128.328 2.651 . . . . 0.0 110.488 171.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.3 mt -136.75 -164.48 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.785 2.834 . . . . 0.0 109.231 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.15 149.05 51.03 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.877 1.271 . . . . 0.0 110.691 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.56 -38.14 66.29 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.71 1.204 . . . . 0.0 113.452 -169.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -55.87 -42.01 75.24 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.598 1.09 . . . . 0.0 112.865 174.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -67.67 -37.62 82.61 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 117.958 -1.02 . . . . 0.0 111.114 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.4 mm -72.02 -38.59 64.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 118.606 0.639 . . . . 0.0 111.854 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.65 -57.5 12.13 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.17 1.388 . . . . 0.0 111.393 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 84.5 mt -57.38 -41.91 79.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-N 118.751 0.705 . . . . 0.0 110.826 175.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.0 t90 -59.59 -55.22 37.23 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 119.516 1.053 . . . . 0.0 112.858 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -62.75 -44.83 95.19 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 119.339 0.972 . . . . 0.0 111.135 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.79 -44.52 86.35 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 119.424 1.011 . . . . 0.0 111.59 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -60.34 -49.7 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 119.773 1.169 . . . . 0.0 112.194 173.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -58.07 9.45 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.136 0.974 . . . . 0.0 112.43 176.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -38.27 87.73 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.702 1.601 . . . . 0.0 111.867 -178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.46 -47.07 80.4 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.012 1.278 . . . . 0.0 112.165 171.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.2 tttt -86.57 -11.13 52.42 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -171.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.3 tp -31.61 -62.53 0.19 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 127.196 2.198 . . . . 0.0 113.84 -168.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -62.68 -33.49 75.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.9 51.12 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.135 1.334 . . . . 0.0 112.595 172.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.9 t 48.7 -115.7 0.77 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 126.75 2.02 . . . . 0.0 112.215 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.1 t60 -152.77 -176.72 5.86 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.211 1.805 . . . . 0.0 110.694 160.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.66 78.88 0.29 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.364 1.065 . . . . 0.0 109.039 153.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -136.04 143.8 44.9 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 121.743 0.782 . . . . 0.0 112.284 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 93.1 p -151.3 54.1 0.86 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.382 1.473 . . . . 0.0 112.021 -162.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -144.94 76.98 1.51 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.001 1.32 . . . . 0.0 110.546 175.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -150.86 156.77 41.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.78 1.232 . . . . 0.0 111.077 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.5 tt -83.28 74.74 10.01 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.099 0.96 . . . . 0.0 111.257 -177.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 45.2 ttp . . . . . 0 C--O 1.248 0.977 0 CA-C-O 116.523 -1.703 . . . . 0.0 111.948 156.407 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.042 0 CA-C-O 119.273 -0.737 . . . . 0.0 111.903 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 119.73 19.45 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.654 1 C-N-CA 133.552 4.741 . . . . 0.0 112.343 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -73.57 158.54 86.23 Favored Pre-proline 0 N--CA 1.479 0.999 0 C-N-CA 125.01 1.324 . . . . 0.0 112.034 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -79.31 47.0 2.36 Favored 'Trans proline' 0 CA--C 1.549 1.243 0 C-N-CA 123.946 3.097 . . . . 0.0 114.893 -173.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 34.1 ttt85 -142.88 88.4 2.05 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.29 1.836 . . . . 0.0 109.169 165.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.0 m -74.34 -23.19 59.0 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.537 0.735 . . . . 0.0 112.277 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.07 107.37 0.22 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.481 1.512 . . . . 0.0 114.173 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.1 -171.52 0.75 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.306 2.242 . . . . 0.0 113.224 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.1 t -66.46 147.05 53.84 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.725 0.81 . . . . 0.0 110.41 158.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mp0 -52.09 -34.99 46.47 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.788 0.835 . . . . 0.0 112.717 172.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -69.13 -11.48 60.83 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 178.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -89.71 -44.69 9.84 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.338 1.855 . . . . 0.0 110.407 166.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.8 mm -54.69 -42.35 60.73 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 C-N-CA 125.4 1.48 . . . . 0.0 110.765 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -50.42 -47.45 56.62 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 173.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -67.61 -43.07 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 119.653 1.115 . . . . 0.0 110.081 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.3 mt -65.87 -43.38 88.52 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.263 1.025 . . . . 0.0 112.213 -179.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.448 ' CD ' HH12 ' A' ' 52' ' ' ARG . 24.2 mt-10 -63.45 -43.36 97.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.724 1.147 . . . . 0.0 113.006 170.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -59.4 -36.5 75.94 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.8 t -71.45 -45.55 68.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 120.227 1.376 . . . . 0.0 111.483 171.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -54.3 -34.34 60.74 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.078 0.951 . . . . 0.0 113.047 176.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -54.02 -39.23 65.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.738 2.015 . . . . 0.0 113.733 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 19.6 t -88.91 -45.98 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.594 1.558 . . . . 0.0 110.821 174.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -130.17 88.45 2.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.8 1.64 . . . . 0.0 111.498 -168.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.9 m -58.01 -21.49 45.15 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -153.24 88.37 3.77 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.275 1.83 . . . . 0.0 108.58 172.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -78.96 177.91 8.16 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.52 2.813 . . . . 0.0 112.78 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.07 164.84 54.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.657 0.646 . . . . 0.0 113.744 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 27.3 mm -62.07 -43.38 97.63 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 O-C-N 121.97 -0.724 . . . . 0.0 112.311 -171.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.42 -23.73 64.61 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 119.389 0.995 . . . . 0.0 113.175 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 22.8 mm -81.71 -40.61 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 125.674 1.59 . . . . 0.0 110.173 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.67 -49.82 71.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.07 0.948 . . . . 0.0 111.624 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -59.98 -39.24 85.02 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 169.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.04 -48.46 67.6 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 120.799 1.636 . . . . 0.0 112.702 170.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.2 mt -67.69 -40.08 84.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.83 0.852 . . . . 0.0 112.12 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.63 -55.92 21.66 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.608 1.163 . . . . 0.0 110.992 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -62.9 -51.74 65.77 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.753 -0.592 . . . . 0.0 111.954 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -72.43 -8.35 54.58 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 -172.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.6 mt -120.87 4.63 10.49 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.026 1.33 . . . . 0.0 112.382 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 22.8 t30 37.23 75.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 128.425 2.69 . . . . 0.0 112.684 -165.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.5 mt -135.89 164.78 27.16 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 128.039 2.536 . . . . 0.0 107.79 169.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -87.91 155.24 19.95 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 120.704 -1.248 . . . . 0.0 112.184 166.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -45.01 -49.91 11.03 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.38 1.872 . . . . 0.0 111.646 175.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.08 -39.13 77.77 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.643 1.177 . . . . 0.0 113.839 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -67.95 -43.22 79.59 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.749 -1.22 . . . . 0.0 111.141 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.5 mm -66.14 -42.01 90.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 118.621 0.646 . . . . 0.0 111.026 175.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -56.5 -52.09 66.05 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 119.318 0.963 . . . . 0.0 112.123 172.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -59.25 -37.68 70.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 O-C-N 121.25 -0.906 . . . . 0.0 111.58 173.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.7 t90 -60.66 -59.93 4.6 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 120.514 1.506 . . . . 0.0 112.267 171.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -55.17 -47.42 75.19 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.975 0.51 . . . . 0.0 111.59 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -62.66 -39.45 93.95 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 116.831 -1.557 . . . . 0.0 112.856 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -60.65 -40.04 90.58 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 121.427 1.921 . . . . 0.0 111.443 173.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.448 HH12 ' CD ' ' A' ' 17' ' ' GLU . 12.4 mmt85 -66.22 -55.46 16.08 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER -69.04 -18.4 64.01 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 177.809 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.12 -60.66 2.2 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 119.745 1.157 . . . . 0.0 111.368 162.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -53.76 -41.93 67.69 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.309 0.958 . . . . 0.0 112.536 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 67.1 tp -39.82 -48.23 2.23 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.678 1.991 . . . . 0.0 112.996 175.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -133.18 60.95 1.69 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.843 1.257 . . . . 0.0 109.79 171.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.2 ttm-85 -63.8 142.91 58.23 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.884 -0.51 . . . . 0.0 110.62 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.0 t -62.81 130.9 46.92 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 161.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -81.34 41.29 0.6 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 125.349 1.46 . . . . 0.0 111.674 -175.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -85.02 173.36 10.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.986 2.514 . . . . 0.0 114.943 -164.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -108.11 163.63 12.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.302 1.841 . . . . 0.0 112.127 175.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.9 t -144.4 172.01 13.54 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.064 1.346 . . . . 0.0 109.759 154.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -114.41 123.71 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.542 1.537 . . . . 0.0 110.177 -176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -156.81 156.1 32.67 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.758 1.623 . . . . 0.0 109.228 173.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -141.06 174.24 10.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.303 1.441 . . . . 0.0 111.588 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 C--O 1.25 1.101 0 C-N-CA 126.591 1.956 . . . . 0.0 108.837 164.693 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.681 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -75.5 93.07 2.94 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.56 -0.965 . . . . 0.0 113.061 -163.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.4 ttm180 -134.04 88.12 32.58 Favored Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 124.585 1.154 . . . . 0.0 113.165 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -61.35 155.25 53.12 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 121.861 1.707 . . . . 0.0 110.912 169.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 33.81 55.47 0.56 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 127.362 2.265 . . . . 0.0 113.537 -166.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.3 m -59.76 138.8 57.67 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.454 -0.779 . . . . 0.0 110.749 170.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -133.33 174.33 10.51 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.91 1.684 . . . . 0.0 110.003 167.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -136.34 -173.06 3.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.934 2.093 . . . . 0.0 110.601 -169.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.6 t -57.07 145.96 29.03 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.634 -0.667 . . . . 0.0 111.042 162.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -58.81 -24.08 61.36 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.38 -41.16 96.66 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.372 0.987 . . . . 0.0 113.398 169.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -79.92 -30.68 40.08 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.156 0.982 . . . . 0.0 111.816 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 14.6 mm -62.36 -49.14 85.13 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.478 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.281 168.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.26 -31.06 71.58 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 120.296 1.407 . . . . 0.0 114.213 -176.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 75.4 t -66.12 -46.82 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.018 0.826 . . . . 0.0 110.758 170.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.9 mt -66.4 -43.08 86.78 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.305 1.042 . . . . 0.0 112.654 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -52.99 -52.57 57.89 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.846 1.658 . . . . 0.0 112.135 164.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -54.43 -46.42 73.23 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.899 0.772 . . . . 0.0 112.405 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 75.7 t -58.77 -52.02 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.362 172.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -56.23 -41.36 75.56 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.681 1.582 . . . . 0.0 112.177 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -61.73 -25.47 67.45 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.119 1.767 . . . . 0.0 113.521 -179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.6 t -100.65 -28.33 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.942 1.697 . . . . 0.0 112.284 173.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -140.96 83.6 1.89 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.59 2.356 . . . . 0.0 111.147 -171.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 58.5 m -57.42 -25.19 59.21 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -135.24 96.81 13.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.642 1.577 . . . . 0.0 109.944 166.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -71.92 163.61 38.29 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.472 2.115 . . . . 0.0 111.447 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.87 169.26 50.15 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.064 0.84 . . . . 0.0 113.176 172.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 20.3 mm -61.77 -38.64 80.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 O-C-N 121.695 -0.885 . . . . 0.0 111.937 -176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -30.19 69.94 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.955 1.302 . . . . 0.0 112.252 177.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.0 mt -71.65 -41.31 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 119.3 0.955 . . . . 0.0 110.038 170.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.02 -46.66 88.76 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.667 -0.646 . . . . 0.0 111.845 172.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -63.21 -37.9 89.07 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.686 1.595 . . . . 0.0 114.294 172.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -68.41 -38.81 81.61 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.016 -1.052 . . . . 0.0 111.924 174.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.4 mt -64.14 -45.96 86.18 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.445 0.698 . . . . 0.0 111.329 170.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.87 -60.14 3.52 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.867 1.267 . . . . 0.0 111.388 174.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 53.4 tp60 -63.21 -27.02 69.07 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -107.48 -4.62 18.27 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -108.54 -6.53 16.05 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.77 2.028 . . . . 0.0 112.13 165.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 53.75 60.96 3.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.665 1.586 . . . . 0.0 111.388 -170.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.4 mt -131.53 155.24 47.79 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 127.372 2.269 . . . . 0.0 109.197 174.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.529 ' CD ' ' HE ' ' A' ' 44' ' ' ARG . 4.8 pm0 -76.36 142.89 41.04 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-O 122.784 1.278 . . . . 0.0 111.066 160.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.7 tt -50.58 -35.71 31.36 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 124.958 1.303 . . . . 0.0 111.594 175.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -50.33 -51.29 46.75 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.253 1.821 . . . . 0.0 113.229 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.529 ' HE ' ' CD ' ' A' ' 41' ' ' GLU . 85.9 mtt-85 -63.67 -41.55 98.16 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 121.559 -0.713 . . . . 0.0 111.395 176.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 48.5 mt -70.38 -37.2 69.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -61.35 -51.52 68.5 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.014 1.326 . . . . 0.0 110.533 172.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.4 mt -57.78 -42.49 82.04 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 118.079 -0.962 . . . . 0.0 110.404 173.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 77.3 t90 -58.1 -62.4 1.85 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.285 1.402 . . . . 0.0 112.277 174.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -55.6 -45.28 77.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 119.229 0.922 . . . . 0.0 112.519 -177.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -63.92 -38.61 91.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.717 -1.135 . . . . 0.0 112.534 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -60.96 -46.41 90.81 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.397 1.453 . . . . 0.0 112.502 170.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.94 -50.72 72.28 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.392 0.996 . . . . 0.0 111.866 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -57.02 -43.69 82.1 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.054 0.941 . . . . 0.0 112.166 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.77 -47.07 85.97 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 119.102 0.864 . . . . 0.0 113.071 173.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -59.34 -44.38 92.66 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.736 0.815 . . . . 0.0 112.163 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.17 12.36 0.12 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.298 1.839 . . . . 0.0 115.216 178.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -128.93 -47.87 1.23 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.462 1.905 . . . . 0.0 110.961 169.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.23 154.57 7.82 Favored 'General case' 0 N--CA 1.481 1.124 0 O-C-N 121.434 -0.791 . . . . 0.0 111.602 177.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.2 t 67.44 17.39 10.08 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.721 1.749 . . . . 0.0 115.721 176.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -51.61 -29.46 17.59 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 120.026 1.285 . . . . 0.0 114.036 169.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 19.6 ttt-85 66.83 8.82 6.3 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 127.941 2.496 . . . . 0.0 116.89 164.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -55.96 138.65 48.45 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.993 0.917 . . . . 0.0 111.965 174.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.7 m -75.78 55.43 0.87 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.247 1.419 . . . . 0.0 114.137 -178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -140.22 119.97 13.39 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.672 1.589 . . . . 0.0 109.343 172.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -152.37 87.64 1.33 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.439 0.696 . . . . 0.0 111.298 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.9 mp -134.54 156.14 49.17 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.592 1.557 . . . . 0.0 109.974 171.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.1 tmt? . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.467 1.907 . . . . 0.0 111.041 -179.063 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.238 0 CA-C-O 118.704 -1.053 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -129.05 163.83 24.56 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 118.747 1.274 . . . . 0.0 112.106 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 18.18 72.07 0.21 Allowed Pre-proline 0 N--CA 1.486 1.343 0 C-N-CA 128.874 2.87 . . . . 0.0 115.688 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.46 44.89 1.32 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 124.637 3.558 . . . . 0.0 112.71 175.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.2 ttm105 -156.47 142.38 17.96 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 127.222 2.209 . . . . 0.0 109.452 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.8 m -143.44 108.88 5.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.887 0.375 . . . . 0.0 109.99 177.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -109.7 161.03 15.8 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.956 0.902 . . . . 0.0 110.55 166.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -129.7 -165.11 1.48 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.201 1.8 . . . . 0.0 111.095 -166.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -61.33 144.42 53.99 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.962 -0.461 . . . . 0.0 109.792 156.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.32 -28.45 67.99 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 120.362 -1.461 . . . . 0.0 113.395 -174.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -68.84 -1.81 8.07 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 114.93 1.455 . . . . 0.0 114.93 170.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -104.82 -38.74 6.55 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 126.129 1.772 . . . . 0.0 111.031 166.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mm -55.43 -53.06 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 123.585 0.754 . . . . 0.0 111.352 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.92 -26.82 68.47 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -176.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.8 t -66.0 -51.44 60.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 120.405 1.457 . . . . 0.0 109.849 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.6 mt -59.0 -47.12 86.34 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.608 0.763 . . . . 0.0 111.504 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -71.09 -30.32 66.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 117.183 -1.389 . . . . 0.0 114.661 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -66.28 -17.21 64.61 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 121.072 1.76 . . . . 0.0 112.948 166.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.62 -52.0 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 120.266 1.394 . . . . 0.0 111.859 161.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -55.47 -31.34 61.9 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.478 1.035 . . . . 0.0 113.722 178.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 45.8 tpt85 -53.27 -11.94 0.35 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 131.488 3.915 . . . . 0.0 115.423 168.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 44.2 t -132.77 -54.59 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 127.3 2.24 . . . . 0.0 110.703 175.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -100.87 92.0 4.85 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.731 1.613 . . . . 0.0 111.582 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.6 m -55.2 -32.35 62.15 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 176.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -144.69 97.33 5.01 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.386 1.875 . . . . 0.0 108.682 170.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -79.37 179.85 6.02 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.371 2.714 . . . . 0.0 113.116 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.21 162.16 54.46 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.253 0.93 . . . . 0.0 113.202 169.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 17.6 mm -68.04 -29.86 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 O-C-N 121.837 -0.802 . . . . 0.0 111.311 -178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.98 -33.47 75.81 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.373 1.869 . . . . 0.0 113.335 171.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.6 mm -71.42 -41.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.324 0 CA-C-N 119.021 0.828 . . . . 0.0 110.434 170.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.44 -41.57 96.48 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 118.838 -0.601 . . . . 0.0 111.864 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.26 -50.41 74.09 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.876 2.07 . . . . 0.0 113.172 167.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -58.45 -41.02 84.19 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.595 1.089 . . . . 0.0 112.523 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 80.8 mt -65.16 -48.64 72.82 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.053 0.941 . . . . 0.0 112.077 170.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.71 -48.14 69.86 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.282 1.033 . . . . 0.0 111.864 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -55.88 -60.08 3.97 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.374 1.07 . . . . 0.0 112.394 171.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -65.43 -2.39 3.22 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 116.027 1.862 . . . . 0.0 116.027 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.2 mt -128.26 -6.33 5.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.275 1.43 . . . . 0.0 113.701 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 43.45 73.15 0.15 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 125.067 1.347 . . . . 0.0 110.928 -158.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.6 mt -135.45 -173.89 3.48 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.344 1.857 . . . . 0.0 109.199 171.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -137.2 150.13 47.68 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 125.273 1.429 . . . . 0.0 110.347 -177.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.2 tp -42.39 -54.34 3.85 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.796 1.239 . . . . 0.0 114.328 -171.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.07 -30.24 70.86 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 119.55 1.068 . . . . 0.0 113.684 -178.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -71.92 -37.5 70.04 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.962 1.255 . . . . 0.0 110.643 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -46.82 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.891 0.769 . . . . 0.0 111.454 171.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.5 mm-40 -54.37 -50.48 67.4 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.482 1.037 . . . . 0.0 112.135 174.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.5 mt -62.3 -38.9 82.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 O-C-N 120.649 -1.282 . . . . 0.0 111.511 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -57.41 -57.34 13.08 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 120.324 1.42 . . . . 0.0 111.971 170.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -56.9 -48.58 77.89 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.286 1.034 . . . . 0.0 111.553 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -61.52 -41.29 97.1 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.07 0.948 . . . . 0.0 111.909 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.87 -41.53 95.6 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 120.512 1.506 . . . . 0.0 111.951 174.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.63 -59.99 4.07 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.47 1.108 . . . . 0.0 112.079 172.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -54.08 -49.19 69.64 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.342 1.457 . . . . 0.0 111.45 178.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.36 74.19 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.906 0.775 . . . . 0.0 112.895 175.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -73.14 -32.99 65.25 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.4 mp -64.64 -52.73 55.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.871 0.76 . . . . 0.0 110.753 167.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -57.13 -50.15 73.7 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.052 1.341 . . . . 0.0 111.691 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -90.73 62.7 5.16 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 120.903 -1.123 . . . . 0.0 111.35 165.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -58.54 -53.14 61.74 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.489 0.316 . . . . 0.0 110.716 168.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -136.65 -152.76 0.46 Allowed 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.307 2.243 . . . . 0.0 109.867 178.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -115.72 142.93 46.09 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.883 1.273 . . . . 0.0 110.135 167.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -149.16 177.57 9.5 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.307 1.043 . . . . 0.0 110.811 166.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 t 50.35 38.07 16.95 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.469 1.508 . . . . 0.0 114.78 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -151.6 140.65 21.15 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.18 0.992 . . . . 0.0 110.391 175.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -118.21 167.38 11.56 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.556 1.142 . . . . 0.0 110.142 168.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.0 tp -154.0 127.03 8.33 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.772 1.229 . . . . 0.0 110.109 -178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.982 0 C-N-CA 125.637 1.575 . . . . 0.0 109.23 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.173 0 N-CA-C 108.59 -1.804 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -68.07 -19.83 64.91 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.065 1.432 . . . . 0.0 113.394 176.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -78.81 152.59 77.57 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.695 1.198 . . . . 0.0 112.293 168.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -75.9 56.51 4.79 Favored 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 125.03 3.82 . . . . 0.0 111.954 173.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.59 23.0 4.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.274 1.829 . . . . 0.0 114.05 -168.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 96.7 m -70.8 119.47 14.98 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.567 1.547 . . . . 0.0 112.034 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.51 172.34 7.4 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.687 1.195 . . . . 0.0 112.527 168.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -125.29 -166.59 1.56 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.939 2.096 . . . . 0.0 111.786 -171.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 43.5 p -76.59 152.71 35.83 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.074 0.95 . . . . 0.0 109.982 158.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -59.81 -38.71 82.72 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 120.435 -1.415 . . . . 0.0 113.044 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -68.83 -10.35 56.34 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -90.04 -47.43 7.84 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.771 1.628 . . . . 0.0 110.9 163.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.424 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 22.1 mm -50.94 -47.75 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.367 1.067 . . . . 0.0 111.972 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -61.02 -23.59 65.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.1 t -68.7 -50.76 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 CA-C-N 120.063 1.301 . . . . 0.0 110.114 169.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.8 mp -62.13 -43.68 98.3 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 176.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.72 -42.45 79.22 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.778 -1.201 . . . . 0.0 113.651 169.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.5 -23.71 67.09 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 173.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.4 t -77.3 -47.0 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 CA-C-N 119.91 1.232 . . . . 0.0 111.155 165.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -61.92 -30.96 71.24 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.85 1.66 . . . . 0.0 114.225 -177.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -59.59 -17.99 37.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 120.076 1.307 . . . . 0.0 113.993 175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.8 t -113.22 -37.64 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 126.556 1.943 . . . . 0.0 112.076 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -111.61 91.46 3.67 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.095 1.358 . . . . 0.0 112.274 -170.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.8 p -57.18 -30.5 64.56 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.472 -0.767 . . . . 0.0 112.868 167.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -139.46 114.83 8.18 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 127.854 2.462 . . . . 0.0 108.792 158.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -76.99 179.11 6.84 Favored 'Trans proline' 0 CA--C 1.55 1.31 0 C-N-CA 122.553 2.169 . . . . 0.0 110.724 167.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.71 166.02 39.07 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 121.442 -0.786 . . . . 0.0 113.196 170.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.2 mm -66.46 -36.89 78.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-O 117.918 -1.039 . . . . 0.0 111.848 -177.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.95 -26.56 68.27 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.608 1.549 . . . . 0.0 112.643 173.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 13.4 mm -74.55 -37.22 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 O-C-N 121.047 -1.033 . . . . 0.0 111.055 170.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 38.1 mt -67.5 -42.19 83.25 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.481 -0.762 . . . . 0.0 112.107 172.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.45 -49.02 77.59 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.788 1.635 . . . . 0.0 113.055 167.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -60.1 -43.41 95.59 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.458 1.026 . . . . 0.0 112.14 175.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 59.6 mt -61.0 -45.89 93.01 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.883 0.873 . . . . 0.0 112.075 171.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.36 -51.56 67.86 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.228 1.011 . . . . 0.0 111.519 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -52.94 -63.51 1.12 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.944 1.297 . . . . 0.0 112.418 170.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -69.72 -13.67 62.41 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 116.333 1.975 . . . . 0.0 116.333 -171.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.75 1.76 13.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.465 1.106 . . . . 0.0 112.978 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 1.3 t30 39.09 68.29 0.37 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.53 2.332 . . . . 0.0 112.856 -162.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.7 mt -120.45 -166.68 1.35 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 127.385 2.274 . . . . 0.0 109.036 171.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -134.19 159.19 41.66 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 120.812 -1.18 . . . . 0.0 110.504 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -44.69 -55.27 5.41 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.287 1.835 . . . . 0.0 112.2 -175.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -66.06 -27.37 68.04 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 64.8 mtt-85 -65.88 -37.7 86.82 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 121.548 1.976 . . . . 0.0 110.766 171.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -41.71 76.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-N 118.342 0.519 . . . . 0.0 111.404 174.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -57.99 -52.99 63.22 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 119.099 0.863 . . . . 0.0 111.747 173.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.6 mp -58.71 -36.14 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.96 174.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.424 ' HE1' ' CD1' ' A' ' 13' ' ' ILE . 71.2 t90 -61.89 -60.17 4.04 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.378 1.444 . . . . 0.0 112.218 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -59.74 -43.26 94.32 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.464 0.575 . . . . 0.0 111.385 -178.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.87 -49.03 79.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.918 175.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -59.16 -39.67 83.21 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.858 1.663 . . . . 0.0 111.461 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.12 -62.98 1.43 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.194 0.998 . . . . 0.0 112.694 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . 0.27 5.1 ptm180 -63.18 -35.36 80.05 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.992 1.269 . . . . 0.0 112.985 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.77 -18.49 65.37 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 115.406 1.632 . . . . 0.0 115.406 176.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -131.69 17.97 4.74 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.766 1.226 . . . . 0.0 113.419 -173.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -43.18 -57.13 3.09 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.573 1.949 . . . . 0.0 113.665 -172.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.61 -16.72 64.39 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -76.37 34.84 0.14 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 120.201 1.364 . . . . 0.0 113.715 169.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.7 t -63.16 168.93 3.81 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.894 -1.128 . . . . 0.0 111.906 171.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 39.0 m170 -66.85 -52.71 40.39 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.014 -1.054 . . . . 0.0 110.125 161.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.6 tpp85 -137.7 134.57 35.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.108 2.563 . . . . 0.0 108.61 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -81.88 123.43 28.82 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.015 0.825 . . . . 0.0 111.073 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.0 m -68.19 88.67 0.3 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.918 1.287 . . . . 0.0 113.353 -177.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -133.06 143.9 49.66 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.295 1.438 . . . . 0.0 109.525 162.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -153.99 179.72 8.65 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.385 0.674 . . . . 0.0 112.379 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 24.1 tp -125.59 169.3 12.62 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.54 1.936 . . . . 0.0 111.505 -172.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.2 ttp . . . . . 0 C--O 1.25 1.114 0 C-N-CA 125.175 1.39 . . . . 0.0 111.471 163.83 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.975 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -61.59 118.33 6.91 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.181 1.792 . . . . 0.0 114.033 -175.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 53.68 123.71 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.943 0 C-N-CA 131.342 3.857 . . . . 0.0 114.313 -164.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.46 65.96 7.28 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 C-N-CA 123.696 2.93 . . . . 0.0 112.575 -176.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -125.76 58.22 1.33 Allowed 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.406 1.882 . . . . 0.0 110.264 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -74.68 81.56 2.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.711 1.204 . . . . 0.0 112.661 -173.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -78.89 164.13 24.71 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.038 0.535 . . . . 0.0 111.202 160.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.406 ' H ' HD11 ' A' ' 13' ' ' ILE . 30.3 m-85 -129.46 -172.27 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 127.174 2.19 . . . . 0.0 110.422 172.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.3 t -70.86 148.7 47.53 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.026 -0.421 . . . . 0.0 110.468 164.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -49.62 -41.9 43.46 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.615 1.966 . . . . 0.0 113.874 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.06 -16.59 61.48 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 120.33 1.423 . . . . 0.0 113.838 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -84.12 -40.68 17.94 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.496 1.119 . . . . 0.0 110.32 167.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.406 HD11 ' H ' ' A' ' 8' ' ' PHE . 26.5 mm -54.0 -51.59 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 124.104 0.962 . . . . 0.0 111.586 171.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -55.0 -37.24 66.34 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 85.3 t -66.67 -47.63 82.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 CA-C-N 120.334 1.425 . . . . 0.0 110.857 174.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.8 mt -63.76 -43.87 95.15 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.572 1.149 . . . . 0.0 112.22 179.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -49.87 -55.52 14.01 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.652 1.581 . . . . 0.0 111.087 164.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.7 m-80 -58.27 -12.94 4.15 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.899 1.815 . . . . 0.0 115.899 177.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 98.9 t -86.76 -49.62 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 120.714 1.597 . . . . 0.0 111.701 161.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -54.09 -30.53 48.83 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.342 1.057 . . . . 0.0 113.78 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -53.63 -28.13 31.11 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.783 1.233 . . . . 0.0 114.038 175.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.1 t -110.2 -48.92 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.876 2.07 . . . . 0.0 111.451 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -110.62 82.83 1.66 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.798 1.239 . . . . 0.0 111.667 -175.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 84.3 m -54.4 -33.88 60.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 121.272 -0.893 . . . . 0.0 112.501 169.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -124.9 103.03 31.05 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 126.757 2.023 . . . . 0.0 108.971 167.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -81.18 176.37 8.87 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.859 3.039 . . . . 0.0 112.739 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.94 163.45 31.92 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 124.519 1.057 . . . . 0.0 112.876 169.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 15.9 mm -59.43 -38.11 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 125.019 1.328 . . . . 0.0 111.127 -177.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.52 -27.57 61.43 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.759 2.024 . . . . 0.0 112.325 -177.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 57.5 mt -76.45 -39.85 33.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 124.542 1.137 . . . . 0.0 109.665 170.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.5 mt -62.06 -46.18 90.25 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.682 0.793 . . . . 0.0 111.344 172.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -57.85 -49.93 75.02 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 165.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.47 -30.35 66.91 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.22 1.827 . . . . 0.0 114.614 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -70.57 -49.76 44.51 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.842 0.857 . . . . 0.0 112.263 167.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.37 64.07 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.671 1.189 . . . . 0.0 112.324 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -64.73 -12.36 46.17 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.595 2.758 . . . . 0.0 114.012 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -118.74 -34.89 3.83 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.849 1.26 . . . . 0.0 113.873 -176.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.9 mt -85.95 -13.36 47.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.96 0.904 . . . . 0.0 113.058 178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 67.97 65.84 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.285 2.234 . . . . 0.0 111.856 -169.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 73.9 mt -139.36 177.93 7.56 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.221 2.208 . . . . 0.0 109.699 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -115.46 158.85 21.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.83 1.252 . . . . 0.0 112.002 165.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 tt -54.19 -41.27 68.38 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.492 1.117 . . . . 0.0 113.796 -169.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -33.74 73.66 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.478 1.035 . . . . 0.0 113.257 176.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 10.4 mtp180 -68.69 -39.25 80.64 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 120.628 -1.295 . . . . 0.0 110.546 175.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.61 -47.72 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.04 171.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -54.65 -49.98 69.29 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.751 1.159 . . . . 0.0 111.912 175.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 90.5 mt -62.5 -38.04 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-O 117.558 -1.211 . . . . 0.0 111.222 174.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 89.9 t90 -58.44 -58.21 9.54 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 121.029 1.74 . . . . 0.0 111.542 170.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -54.1 -51.39 64.33 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 118.91 0.777 . . . . 0.0 112.743 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.54 -40.59 83.41 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 118.21 -0.9 . . . . 0.0 112.275 174.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -62.35 -46.66 87.67 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 120.771 1.623 . . . . 0.0 112.896 174.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 mmm180 -61.57 -46.79 88.38 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 120.151 1.341 . . . . 0.0 111.529 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.0 -47.3 85.69 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.801 179.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.72 -54.13 49.9 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.54 1.136 . . . . 0.0 111.623 173.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -56.45 -38.03 71.09 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.533 1.133 . . . . 0.0 112.692 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.38 -45.95 65.01 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.315 1.046 . . . . 0.0 112.179 176.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.4 tttt -63.62 -28.68 70.09 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.942 0.897 . . . . 0.0 112.129 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . 0.262 5.8 ttt180 46.75 -44.91 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.295 1 C-N-CA 134.914 5.286 . . . . 0.0 117.9 177.621 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.0 t 54.23 27.12 7.45 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.647 1.979 . . . . 0.0 115.477 168.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -71.91 172.03 10.68 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.654 1.182 . . . . 0.0 112.747 -175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -126.01 126.65 44.64 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.829 1.252 . . . . 0.0 110.65 163.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 50.9 -175.93 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.097 2.159 . . . . 0.0 113.894 -169.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.2 t -169.41 169.66 8.83 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.435 1.894 . . . . 0.0 109.649 175.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.11 144.26 36.67 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.798 1.239 . . . . 0.0 109.888 159.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -152.13 178.75 9.14 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.266 0.555 . . . . 0.0 112.373 -175.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.5 tp -119.61 -172.8 2.4 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.017 1.727 . . . . 0.0 111.316 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 C--O 1.249 1.053 0 C-N-CA 125.253 1.421 . . . . 0.0 110.322 169.304 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.759 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -97.85 160.75 14.11 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.98 1.712 . . . . 0.0 112.613 -172.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 80.13 124.44 0.03 OUTLIER Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 130.18 3.392 . . . . 0.0 113.56 175.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -76.06 68.59 6.55 Favored 'Trans proline' 0 CA--C 1.548 1.21 0 C-N-CA 122.977 2.451 . . . . 0.0 112.148 171.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 50.22 1.84 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.236 1.415 . . . . 0.0 112.385 176.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -59.73 123.53 17.25 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.948 1.699 . . . . 0.0 113.272 179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -128.18 171.22 12.14 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.118 1.767 . . . . 0.0 110.816 161.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -137.76 -176.66 4.5 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.321 1.848 . . . . 0.0 111.961 -175.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.2 t -66.81 147.07 53.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.265 0.626 . . . . 0.0 110.784 166.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.5 tt0 -55.17 -35.37 64.7 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.42 1.088 . . . . 0.0 113.218 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -5.53 32.34 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 125.266 1.427 . . . . 0.0 114.707 175.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.3 tt0 -109.15 -33.3 6.92 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.49 1.916 . . . . 0.0 111.143 167.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -55.27 -51.96 50.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.28 1.032 . . . . 0.0 111.343 167.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -57.2 -34.42 68.5 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.7 t -69.1 -39.34 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 119.952 1.251 . . . . 0.0 110.173 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.6 mt -69.13 -46.99 66.27 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.376 1.07 . . . . 0.0 111.495 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -58.19 -39.22 78.37 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.093 0.86 . . . . 0.0 112.523 170.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -61.91 -27.97 69.2 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.843 -1.161 . . . . 0.0 114.121 172.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 88.2 t -76.5 -50.77 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 119.975 1.261 . . . . 0.0 111.098 166.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.57 -34.48 71.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.571 1.148 . . . . 0.0 113.62 -176.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -65.25 -17.81 64.8 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 174.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.9 t -98.48 -45.81 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 125.759 1.623 . . . . 0.0 110.77 174.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -133.25 108.03 8.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.456 1.102 . . . . 0.0 112.952 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.5 t -51.3 -39.86 57.78 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.043 1.737 . . . . 0.0 113.002 169.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.38 92.52 20.55 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 126.278 1.831 . . . . 0.0 110.533 175.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.26 176.46 10.07 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 123.185 2.59 . . . . 0.0 112.636 176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.96 170.52 45.57 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.679 1.133 . . . . 0.0 114.647 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 21.8 mm -66.44 -34.89 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.716 -0.873 . . . . 0.0 111.769 -175.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.16 -29.88 70.06 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.171 1.389 . . . . 0.0 112.574 174.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mm -76.22 -40.82 36.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.118 0.967 . . . . 0.0 109.698 174.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.3 mt -62.47 -47.74 82.67 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.723 -0.61 . . . . 0.0 112.06 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -55.72 -55.92 26.56 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.963 1.305 . . . . 0.0 112.401 168.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -62.8 -22.23 66.48 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.24 -1.538 . . . . 0.0 114.013 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -76.42 -50.04 15.17 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.016 -1.052 . . . . 0.0 112.138 164.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.4 -53.28 47.05 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.374 1.47 . . . . 0.0 111.921 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -64.17 -12.7 42.65 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.221 1.408 . . . . 0.0 114.15 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 33.3 ttmt -123.23 -47.05 2.03 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.745 1.157 . . . . 0.0 114.002 -164.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.58 -17.06 61.73 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.526 1.13 . . . . 0.0 112.922 168.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 71.2 74.12 0.18 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.667 2.787 . . . . 0.0 111.191 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -142.3 175.44 9.76 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.367 1.867 . . . . 0.0 109.654 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -99.27 148.96 23.6 Favored 'General case' 0 C--O 1.241 0.656 0 O-C-N 121.658 -0.652 . . . . 0.0 110.324 162.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 tt -42.83 -48.13 5.68 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.184 1.393 . . . . 0.0 112.937 175.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.09 -41.3 87.74 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -65.16 -34.87 79.41 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.595 -1.316 . . . . 0.0 111.646 175.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 49.0 mt -74.6 -42.51 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 118.703 -0.665 . . . . 0.0 112.177 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -52.49 -52.65 53.35 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.249 1.42 . . . . 0.0 111.882 170.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.82 -43.66 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 123.895 0.878 . . . . 0.0 110.693 174.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.4 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 84.4 t90 -55.87 -53.07 61.27 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.99 1.268 . . . . 0.0 112.496 172.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -59.03 -47.48 85.07 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 118.704 0.684 . . . . 0.0 111.671 178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -47.22 83.84 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.288 0.949 . . . . 0.0 111.573 176.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -63.03 -39.4 94.64 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.986 1.266 . . . . 0.0 112.515 177.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.4 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -55.98 -54.63 42.51 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.74 -1.225 . . . . 0.0 112.547 168.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -28.75 67.17 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.276 1.43 . . . . 0.0 113.718 -175.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.35 -32.11 64.35 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 167.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -69.53 -57.95 4.57 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 117.469 -1.253 . . . . 0.0 112.825 172.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp 30.33 59.39 0.21 Allowed 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 126.079 1.752 . . . . 0.0 112.711 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . 0.258 42.7 pttt 50.43 5.79 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 120.203 3.409 . . . . 0.0 120.203 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 12.09 -78.45 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 128.066 2.546 . . . . 0.0 117.347 -166.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.5 m -114.77 17.74 16.92 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.523 1.929 . . . . 0.0 114.048 -168.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -125.95 161.41 27.55 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 120.24 -1.538 . . . . 0.0 113.619 -176.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmp_? -61.56 -56.0 24.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.665 1.586 . . . . 0.0 112.687 173.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 52.23 16.16 0.54 Allowed 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.851 2.06 . . . . 0.0 115.64 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.1 p -69.15 98.2 0.98 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.464 1.506 . . . . 0.0 112.728 176.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.1 123.43 14.79 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.325 1.85 . . . . 0.0 108.218 176.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -150.73 141.56 22.83 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.932 1.293 . . . . 0.0 111.238 -172.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.6 tp -156.8 -62.3 0.1 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.904 1.282 . . . . 0.0 112.939 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 22.8 ptp . . . . . 0 C--O 1.252 1.222 0 C-N-CA 129.144 2.978 . . . . 0.0 111.042 -174.906 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.167 0 CA-C-O 118.479 -1.178 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -61.69 59.7 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 129.062 2.945 . . . . 0.0 117.082 -175.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -134.94 167.77 21.14 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 127.802 2.441 . . . . 0.0 110.993 170.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -78.9 171.67 16.16 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.824 2.35 . . . . 0.0 113.034 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.57 123.21 42.61 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.571 1.548 . . . . 0.0 108.237 166.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 52.4 m 64.1 -80.77 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.35 1.46 . . . . 0.0 114.594 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 50.81 170.07 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 126.497 1.919 . . . . 0.0 115.458 -161.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -135.93 -174.04 3.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.575 1.95 . . . . 0.0 111.301 -168.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.8 t -75.79 152.5 37.32 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 121.515 -0.741 . . . . 0.0 110.434 164.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.09 -25.96 64.24 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -72.06 -3.07 20.87 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 120.981 1.719 . . . . 0.0 114.573 171.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -110.08 -33.41 6.69 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.635 1.974 . . . . 0.0 111.405 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.1 mm -63.04 -44.53 99.65 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.595 0 CA-C-O 117.649 -1.167 . . . . 0.0 111.44 170.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -54.63 -43.89 72.67 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.69 1.586 . . . . 0.0 113.763 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 39.4 t -66.87 -39.98 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.091 0.859 . . . . 0.0 110.47 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.21 -46.35 64.71 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.461 1.105 . . . . 0.0 112.403 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -64.31 -36.13 83.12 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.775 -1.203 . . . . 0.0 112.609 171.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -59.34 -46.34 88.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.659 1.118 . . . . 0.0 112.601 169.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 87.8 t -64.76 -43.25 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 121.256 -0.903 . . . . 0.0 111.241 174.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -54.86 -43.0 72.72 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.704 1.138 . . . . 0.0 112.63 174.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -63.9 -13.1 42.61 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.362 2.265 . . . . 0.0 114.525 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.5 t -102.35 -41.96 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.955 1.702 . . . . 0.0 111.476 169.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -143.87 104.13 4.13 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 127.414 2.286 . . . . 0.0 110.234 -174.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 72.0 m -57.49 -22.26 42.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -158.78 82.47 2.62 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.702 2.001 . . . . 0.0 110.181 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.41 177.9 8.04 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.335 2.69 . . . . 0.0 111.956 177.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.43 167.31 54.81 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 121.785 -0.572 . . . . 0.0 114.337 177.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.1 mm -58.3 -47.34 87.92 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.802 0 C-N-CA 124.148 0.979 . . . . 0.0 111.667 -173.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -62.59 -26.13 68.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.132 0.973 . . . . 0.0 112.767 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.3 mm -74.47 -44.86 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 124.654 1.182 . . . . 0.0 110.285 172.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.3 mt -63.27 -39.77 95.51 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.878 0.871 . . . . 0.0 111.544 173.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -74.01 -33.82 63.94 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.181 1.393 . . . . 0.0 114.458 175.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -59.73 -41.8 91.72 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 120.932 1.696 . . . . 0.0 112.158 166.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.0 mt -61.78 -51.29 68.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.321 0.648 . . . . 0.0 111.402 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.74 -44.06 66.17 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.209 1.004 . . . . 0.0 112.533 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -20.48 27.95 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 126.644 1.977 . . . . 0.0 114.864 177.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -118.31 -36.98 3.42 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.919 1.236 . . . . 0.0 113.53 -176.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.7 mt -73.61 -9.55 58.79 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.1 1.36 . . . . 0.0 113.456 175.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 48.26 77.29 0.1 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.509 2.324 . . . . 0.0 112.425 -165.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.6 mt -139.86 -179.46 5.95 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.085 2.554 . . . . 0.0 108.35 173.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -112.59 159.59 18.69 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.693 1.597 . . . . 0.0 111.623 164.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.63 -46.67 40.18 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.077 1.351 . . . . 0.0 111.981 178.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -54.95 -53.42 55.85 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.81 1.244 . . . . 0.0 113.653 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 57.7 mtt180 -68.0 -31.8 71.75 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.092 0.86 . . . . 0.0 111.923 -178.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -42.28 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.378 0.99 . . . . 0.0 111.029 169.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -57.74 -54.22 49.36 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.844 1.258 . . . . 0.0 112.019 174.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.53 -35.69 64.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.199 -0.938 . . . . 0.0 111.222 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 72.5 t90 -59.46 -56.45 21.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.724 1.602 . . . . 0.0 112.369 170.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -59.66 -43.23 94.0 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.858 0.863 . . . . 0.0 111.991 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -55.85 -47.63 76.94 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.854 1.262 . . . . 0.0 110.284 173.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -74.84 3.3 8.37 Favored 'General case' 0 CA--C 1.549 0.931 0 N-CA-C 115.475 1.657 . . . . 0.0 115.475 174.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.41 -64.27 1.17 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.343 -1.473 . . . . 0.0 109.921 152.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -45.3 72.1 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.722 1.209 . . . . 0.0 112.951 -172.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.9 -5.31 29.74 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -134.31 15.5 3.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.898 1.279 . . . . 0.0 113.499 -178.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.4 tt -43.14 -52.2 5.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.402 1.881 . . . . 0.0 113.812 -172.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -62.72 -32.84 74.02 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 62.94 149.49 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.468 2.307 . . . . 0.0 115.172 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.0 m -68.23 35.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 128.47 2.708 . . . . 0.0 114.66 167.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -144.71 88.26 1.9 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.196 1.398 . . . . 0.0 110.375 -172.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 77.36 135.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 127.943 2.497 . . . . 0.0 113.269 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -61.71 98.49 0.09 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.744 2.418 . . . . 0.0 110.571 -174.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 48.0 m -126.89 92.91 3.63 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 121.205 -0.934 . . . . 0.0 112.511 -165.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -66.83 132.26 47.65 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.644 0.778 . . . . 0.0 112.965 176.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -150.43 147.59 27.73 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 128.423 2.689 . . . . 0.0 108.125 168.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 97.5 mt -132.36 168.69 17.68 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 125.357 1.463 . . . . 0.0 110.323 173.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 25.1 ptp . . . . . 0 C--O 1.248 1.014 0 CA-C-O 117.406 -1.283 . . . . 0.0 112.307 174.276 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.165 0 CA-C-O 118.912 -0.938 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -57.95 100.14 0.05 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 126.07 1.748 . . . . 0.0 112.733 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -149.36 165.69 17.05 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 128.256 2.622 . . . . 0.0 111.317 -179.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -75.45 -175.96 2.7 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 124.944 3.763 . . . . 0.0 114.551 -177.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.5 tmm_? 47.17 59.95 3.73 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 128.242 2.617 . . . . 0.0 113.715 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.1 m -64.81 134.17 53.52 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.833 1.653 . . . . 0.0 112.609 176.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -136.76 164.56 27.99 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.999 1.32 . . . . 0.0 111.128 165.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -128.15 179.91 5.34 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.337 1.855 . . . . 0.0 112.229 -171.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 12.9 t -59.34 146.52 39.4 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 0.0 111.078 166.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -55.67 -36.82 67.5 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.495 -0.753 . . . . 0.0 112.981 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -16.31 45.0 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.466 1.107 . . . . 0.0 113.192 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -99.09 -46.45 5.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.006 1.722 . . . . 0.0 111.132 170.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.9 mm -47.85 -49.09 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.635 1.174 . . . . 0.0 111.848 174.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.95 -31.03 38.18 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.861 1.264 . . . . 0.0 113.674 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.8 t -71.66 -42.94 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 120.844 -1.16 . . . . 0.0 111.232 175.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.2 mp -67.23 -47.52 70.56 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.647 0.779 . . . . 0.0 111.474 175.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.19 -47.76 65.38 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.688 1.195 . . . . 0.0 111.403 170.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -55.51 -41.7 73.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 175.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.08 -47.46 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 CA-C-N 119.497 1.044 . . . . 0.0 111.521 171.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -60.0 -24.01 64.13 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.861 1.664 . . . . 0.0 114.148 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -58.32 -52.3 66.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.523 1.129 . . . . 0.0 111.465 167.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.9 t -75.03 -46.7 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 125.701 1.6 . . . . 0.0 111.902 -176.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -138.12 112.11 8.45 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.941 0.897 . . . . 0.0 111.455 -176.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.7 p -72.94 -14.71 61.51 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 177.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -132.43 76.91 71.29 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.516 2.326 . . . . 0.0 110.494 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -69.02 159.23 54.79 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.566 2.177 . . . . 0.0 112.547 177.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -78.68 166.76 52.41 Favored Glycine 0 CA--C 1.535 1.316 0 C-N-CA 123.725 0.678 . . . . 0.0 112.136 168.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.659 HD12 ' H ' ' A' ' 28' ' ' ILE . 3.2 mp -64.12 -35.04 72.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.739 0 O-C-N 121.803 -0.822 . . . . 0.0 110.698 -174.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.53 -23.96 63.67 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.975 1.31 . . . . 0.0 113.143 175.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.8 mt -82.89 -37.44 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.152 0.981 . . . . 0.0 109.721 175.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 39.4 mt -63.06 -47.88 81.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.874 0.869 . . . . 0.0 111.041 167.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -64.72 -35.75 82.06 Favored 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 172.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -53.67 -51.89 61.74 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.946 1.703 . . . . 0.0 110.982 166.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 72.0 mt -57.9 -45.7 86.06 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.367 0.506 . . . . 0.0 112.367 173.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.82 -53.22 59.32 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.999 0.818 . . . . 0.0 112.163 175.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -69.8 -27.84 65.23 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.9 1.28 . . . . 0.0 113.553 -174.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -92.94 -24.21 18.48 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.117 1.326 . . . . 0.0 114.455 177.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.2 mt -93.83 -17.38 23.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.704 1.002 . . . . 0.0 113.704 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.28 66.14 0.64 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.454 1.901 . . . . 0.0 111.759 -166.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -129.46 -175.62 3.64 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.533 2.333 . . . . 0.0 108.953 167.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.8 pm0 -119.07 153.39 34.83 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.091 1.756 . . . . 0.0 111.776 169.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -48.27 -46.48 35.89 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 126.329 1.852 . . . . 0.0 112.292 -173.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -51.64 -43.77 62.74 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.53 1.532 . . . . 0.0 114.469 175.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -66.61 -41.6 88.16 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.291 -0.88 . . . . 0.0 111.086 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -38.47 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 118.235 0.47 . . . . 0.0 111.422 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -60.77 -52.5 64.84 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 125.07 1.348 . . . . 0.0 111.852 173.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 89.0 mt -57.67 -43.86 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 O-C-N 121.39 -0.819 . . . . 0.0 110.597 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.441 ' CE2' ' HD3' ' A' ' 52' ' ' ARG . 66.7 t90 -58.97 -56.65 19.5 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.617 1.099 . . . . 0.0 112.249 176.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -63.81 -39.52 94.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.119 0.872 . . . . 0.0 112.675 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -62.52 -47.83 82.21 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.599 1.091 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -60.18 -42.19 94.5 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.797 1.18 . . . . 0.0 111.771 174.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.441 ' HD3' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -62.45 -52.08 64.95 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.063 0.945 . . . . 0.0 113.05 178.608 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -41.83 98.27 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 117.099 -1.429 . . . . 0.0 111.142 176.02 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.63 -54.2 48.8 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.576 1.08 . . . . 0.0 112.345 172.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -55.24 -51.35 66.88 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 120.94 -1.1 . . . . 0.0 112.215 176.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -68.02 11.65 0.14 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 125.557 1.543 . . . . 0.0 114.553 174.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -126.97 -14.57 5.53 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 120.128 -1.608 . . . . 0.0 114.322 160.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 tpt180 -73.72 -53.44 10.35 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.128 1.371 . . . . 0.0 111.686 165.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.8 m -83.4 49.17 1.52 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.956 1.703 . . . . 0.0 113.675 -169.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -141.67 86.67 2.01 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 127.03 2.132 . . . . 0.0 106.568 161.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' HB3' ' H ' ' A' ' 62' ' ' GLU . 0.0 OUTLIER -148.76 -111.24 0.07 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.361 1.064 . . . . 0.0 110.863 -170.262 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.407 ' H ' ' HB3' ' A' ' 61' ' ' ARG . 12.5 mp0 -63.29 116.82 5.83 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.173 1.789 . . . . 0.0 112.505 173.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 m -77.31 62.67 2.38 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.65 1.18 . . . . 0.0 112.181 178.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -126.91 105.09 8.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.463 1.105 . . . . 0.0 112.696 -167.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -71.99 152.01 42.79 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.125 -0.359 . . . . 0.0 110.095 158.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.0 tp -105.64 -115.48 0.24 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.992 0.917 . . . . 0.0 110.819 -175.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.4 tmm? . . . . . 0 C--O 1.246 0.869 0 C-N-CA 126.715 2.006 . . . . 0.0 108.906 178.679 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.826 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -64.32 -71.17 0.19 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.728 2.011 . . . . 0.0 114.855 -173.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.5 mtp180 -143.48 86.4 8.92 Favored Pre-proline 0 N--CA 1.484 1.237 0 C-N-CA 126.702 2.001 . . . . 0.0 110.56 -171.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -72.6 177.3 7.65 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.992 2.461 . . . . 0.0 112.6 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.37 141.58 8.7 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.621 -0.674 . . . . 0.0 111.581 169.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.6 m -125.71 144.56 50.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.64 0.776 . . . . 0.0 111.755 -163.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -124.97 173.58 8.56 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.567 1.547 . . . . 0.0 111.642 172.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -131.32 -173.19 3.04 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.543 2.337 . . . . 0.0 110.212 -174.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.0 t -63.14 147.99 49.26 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.479 -0.763 . . . . 0.0 110.397 160.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -53.02 -34.14 54.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.407 172.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -26.67 64.43 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.512 1.051 . . . . 0.0 112.909 178.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -82.67 -53.48 5.89 Favored 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 126.175 1.79 . . . . 0.0 110.12 171.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.412 HD12 ' HE1' ' A' ' 48' ' ' TRP . 18.7 mm -53.48 -44.15 55.08 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.648 0 C-N-CA 125.101 1.36 . . . . 0.0 111.328 -176.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -54.23 -40.9 68.12 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.805 1.184 . . . . 0.0 112.578 175.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.39 -46.31 90.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.452 -1.405 . . . . 0.0 110.768 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.416 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 5.3 mp -61.74 -48.89 78.66 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 174.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -53.21 -52.05 60.15 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.992 1.717 . . . . 0.0 112.669 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -71.92 -20.33 61.78 Favored 'General case' 0 CA--C 1.553 1.082 0 CA-C-N 119.098 0.863 . . . . 0.0 112.396 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.7 t -68.0 -55.3 17.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-N 119.876 1.217 . . . . 0.0 111.329 161.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -53.85 -38.92 65.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.758 1.623 . . . . 0.0 112.775 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.4 ttt85 -56.16 -24.38 40.88 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 127.102 2.161 . . . . 0.0 114.768 172.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.0 t -109.82 -26.36 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 126.111 1.764 . . . . 0.0 112.524 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -135.48 96.12 3.4 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.367 1.467 . . . . 0.0 111.18 177.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 71.6 m -64.89 -9.97 25.16 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.067 1.747 . . . . 0.0 114.876 -176.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -157.51 88.96 2.48 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 126.537 1.935 . . . . 0.0 109.642 169.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.37 161.24 43.12 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.798 1.665 . . . . 0.0 112.196 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.04 166.33 48.34 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 123.625 0.631 . . . . 0.0 113.31 177.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -56.12 -43.16 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.052 0.941 . . . . 0.0 112.148 -172.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -70.57 -20.14 62.81 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -176.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.6 mm -79.37 -38.24 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.52 1.128 . . . . 0.0 110.744 169.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.8 mt -64.52 -43.94 92.47 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.84 0.856 . . . . 0.0 111.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -58.64 -50.75 72.7 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.948 1.699 . . . . 0.0 113.208 167.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -55.09 -42.33 72.73 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.277 1.399 . . . . 0.0 112.249 177.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.9 mt -62.77 -46.82 86.24 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.506 -0.746 . . . . 0.0 112.206 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.73 -52.27 66.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 119.356 0.98 . . . . 0.0 111.817 177.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.36 -44.46 80.13 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.319 1.848 . . . . 0.0 112.616 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -101.89 -15.1 16.97 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -167.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.4 mt -95.31 -5.76 42.78 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.912 1.285 . . . . 0.0 113.039 171.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 53.63 71.3 0.51 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.647 1.979 . . . . 0.0 112.521 -165.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.6 mt -133.41 -178.8 5.15 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.164 2.185 . . . . 0.0 109.558 171.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.59 141.5 47.68 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.155 0.982 . . . . 0.0 110.385 173.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -46.39 -51.94 13.93 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.663 1.585 . . . . 0.0 111.9 -175.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -57.65 -41.97 82.54 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.194 0.998 . . . . 0.0 112.812 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 70.5 mtt180 -64.13 -35.33 80.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.596 -1.315 . . . . 0.0 111.758 174.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.6 mt -73.12 -38.3 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.228 0.922 . . . . 0.0 111.857 175.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -57.67 -56.19 25.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.883 1.22 . . . . 0.0 111.979 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.2 mp -59.26 -37.81 71.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-O 117.297 -1.335 . . . . 0.0 110.889 174.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.416 ' CZ3' ' HB3' ' A' ' 16' ' ' LEU . 80.7 t90 -55.58 -63.83 1.04 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.054 1.752 . . . . 0.0 111.164 170.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -55.72 -45.14 78.0 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.685 1.129 . . . . 0.0 112.354 -176.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.96 -37.19 86.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 118.282 -0.866 . . . . 0.0 112.736 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -62.21 -46.69 87.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.178 1.354 . . . . 0.0 111.57 171.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.408 ' HG3' ' CH2' ' A' ' 48' ' ' TRP . 18.1 mmm180 -55.06 -53.76 51.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.086 0.857 . . . . 0.0 111.559 176.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -60.53 -44.85 95.62 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.706 0.802 . . . . 0.0 112.111 -178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.61 -48.42 81.03 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 171.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.98 -43.48 98.67 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.049 1.34 . . . . 0.0 112.661 -178.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.25 -29.44 70.54 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.08 0.855 . . . . 0.0 112.3 174.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -80.66 -44.14 19.29 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 58.8 mtt85 51.94 -161.6 0.09 Allowed 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.178 1.391 . . . . 0.0 112.791 -174.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.3 m -64.49 153.45 38.9 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.906 -1.121 . . . . 0.0 110.869 158.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.7 m80 -69.67 146.12 51.86 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.44 0.638 . . . . 0.0 111.939 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -148.16 98.16 2.88 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.918 1.687 . . . . 0.0 110.424 -168.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -78.4 93.58 4.74 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -173.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 76.5 p -120.68 173.33 7.26 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.392 1.477 . . . . 0.0 112.63 168.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -138.96 -177.48 4.9 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.286 1.834 . . . . 0.0 110.197 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -146.95 163.88 34.76 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.977 0.911 . . . . 0.0 111.458 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.2 tp -138.59 -174.05 3.72 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.987 1.715 . . . . 0.0 111.856 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.3 ttt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.958 1.703 . . . . 0.0 111.424 179.039 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 109.989 -1.244 . . . . 0.0 109.989 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.1 mtm105 -95.89 -170.66 2.17 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.379 1.472 . . . . 0.0 112.653 -169.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 64.7 169.52 0.1 OUTLIER Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 128.39 2.676 . . . . 0.0 114.219 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.42 176.85 9.12 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.964 2.443 . . . . 0.0 112.237 171.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.84 113.76 0.51 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.58 1.152 . . . . 0.0 109.488 162.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.4 m -95.14 158.81 15.3 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.818 1.247 . . . . 0.0 110.478 -176.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.82 171.38 14.3 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.939 1.696 . . . . 0.0 110.107 169.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -135.37 -170.01 2.51 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.79 2.036 . . . . 0.0 111.128 -178.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 11.2 t -73.75 146.17 44.55 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.223 -0.923 . . . . 0.0 110.979 159.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -56.88 -31.59 65.0 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.656 1.183 . . . . 0.0 113.586 -179.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -21.97 63.46 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 121.188 -0.945 . . . . 0.0 113.071 173.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -75.41 -54.16 7.52 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.767 1.227 . . . . 0.0 108.687 164.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.5 mm -48.64 -50.47 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.003 1.321 . . . . 0.0 112.118 -178.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -59.36 -26.92 65.48 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -64.54 -51.97 61.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 CA-C-N 122.027 2.194 . . . . 0.0 110.471 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.42 ' HB3' ' CZ3' ' A' ' 48' ' ' TRP . 2.6 mm? -59.87 -46.08 90.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 112.603 176.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -52.75 -49.06 66.24 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.779 1.232 . . . . 0.0 113.07 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 -65.76 -15.31 62.73 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 60.5 t -83.43 -50.04 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 119.277 0.944 . . . . 0.0 111.193 161.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -55.5 -38.82 69.66 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.422 . . . . 0.0 113.999 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.61 -7.5 33.47 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 176.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.5 t -119.05 -35.18 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.981 1.712 . . . . 0.0 111.727 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -139.73 93.92 2.71 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 128.585 2.754 . . . . 0.0 109.229 179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.9 p -59.0 -26.39 64.47 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -140.88 106.1 6.28 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 126.43 1.892 . . . . 0.0 108.87 159.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.68 -179.83 5.82 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 123.265 2.643 . . . . 0.0 111.779 174.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -73.86 167.8 54.35 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.001 0.81 . . . . 0.0 114.299 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.0 mm -61.65 -41.55 90.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.005 0.922 . . . . 0.0 111.669 -176.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.52 -31.0 67.5 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 125.968 1.707 . . . . 0.0 112.832 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 20.8 mm -76.52 -38.78 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 123.577 0.751 . . . . 0.0 110.365 173.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.3 mt -62.17 -44.6 96.25 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.539 -0.725 . . . . 0.0 112.063 170.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -65.26 -41.38 94.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 126.19 1.796 . . . . 0.0 114.34 172.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.66 -43.5 93.41 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.683 1.128 . . . . 0.0 111.736 172.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 75.1 mt -61.25 -42.03 97.92 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 120.591 -1.318 . . . . 0.0 111.704 172.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.86 -58.63 7.04 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.236 1.014 . . . . 0.0 111.239 174.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -64.99 -37.2 86.89 Favored 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -70.41 -41.86 72.38 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.497 -1.377 . . . . 0.0 114.483 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 47.4 mt -90.85 -1.91 57.8 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.112 1.365 . . . . 0.0 112.696 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 48.64 50.51 17.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.07 2.548 . . . . 0.0 113.895 -170.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.0 mt -108.57 171.83 7.19 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.223 1.809 . . . . 0.0 110.037 170.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -93.89 140.01 30.21 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.509 1.147 . . . . 0.0 110.927 159.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -16.01 59.37 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -173.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -67.33 -43.7 80.92 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.735 1.614 . . . . 0.0 111.355 170.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -63.35 -38.59 91.75 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 120.719 -1.238 . . . . 0.0 111.491 171.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.6 mt -69.42 -41.32 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.504 175.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -53.85 -52.67 59.68 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.289 0.95 . . . . 0.0 112.387 169.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.06 -42.43 82.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 117.934 -1.031 . . . . 0.0 111.302 172.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.424 ' CZ2' ' HD3' ' A' ' 52' ' ' ARG . 87.1 t90 -56.81 -52.99 62.92 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 121.013 1.733 . . . . 0.0 112.283 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -61.8 -48.54 80.14 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 118.417 0.553 . . . . 0.0 112.239 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -55.48 -39.7 70.74 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.441 1.019 . . . . 0.0 112.136 175.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 -61.31 -43.12 99.39 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.343 -1.473 . . . . 0.0 112.779 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HD3' ' CZ2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -58.25 -58.95 6.21 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 119.148 0.885 . . . . 0.0 111.75 171.142 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -30.23 71.36 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.76 0.824 . . . . 0.0 111.715 -172.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.66 -58.11 9.36 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.009 0.924 . . . . 0.0 112.028 165.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.92 -50.38 61.23 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.762 0.825 . . . . 0.0 111.32 178.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.1 tt -58.1 -10.2 1.78 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.666 1.986 . . . . 0.0 114.726 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 7.06 7.7 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 170.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 14.0 ttt85 -76.2 -169.26 1.11 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.484 1.914 . . . . 0.0 109.63 162.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.0 m 22.06 79.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 128.24 2.616 . . . . 0.0 114.585 154.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -71.65 61.86 0.38 Allowed 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -162.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -151.1 80.43 1.31 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 128.93 2.892 . . . . 0.0 108.631 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -162.77 152.59 15.88 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.448 1.899 . . . . 0.0 108.211 173.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 65.2 m -68.89 88.57 0.39 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.614 1.097 . . . . 0.0 112.588 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -54.41 -66.57 0.38 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.598 1.559 . . . . 0.0 113.616 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -145.47 110.14 5.07 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.049 1.339 . . . . 0.0 111.214 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 49.2 mt 50.18 59.43 4.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.762 1.625 . . . . 0.0 112.601 176.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.2 tmm? . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.12 1.768 . . . . 0.0 110.671 -174.106 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.036 0 N-CA-C 108.119 -1.992 . . . . 0.0 108.119 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.41 ' H ' ' HD3' ' A' ' 2' ' ' ARG . 0.0 OUTLIER 0.58 -91.62 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 129.469 3.108 . . . . 0.0 114.984 173.025 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -162.26 84.1 1.61 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 127.763 2.425 . . . . 0.0 110.164 -167.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -72.89 82.37 1.52 Allowed 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.195 2.596 . . . . 0.0 111.301 179.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 56.92 -6.72 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 129.626 3.171 . . . . 0.0 116.805 -172.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.5 m 32.96 -84.59 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 130.443 3.497 . . . . 0.0 113.331 -161.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 48.45 171.03 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 128.083 2.553 . . . . 0.0 115.428 -168.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -137.58 -174.72 3.85 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.642 1.977 . . . . 0.0 110.276 -176.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -66.79 148.83 51.41 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.878 0.471 . . . . 0.0 110.701 159.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -57.49 -31.65 66.21 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.902 0.774 . . . . 0.0 112.158 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -14.16 60.22 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.536 HE21 HD11 ' A' ' 40' ' ' LEU . 1.8 tp60 -90.32 -43.75 10.14 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.185 1.794 . . . . 0.0 110.738 168.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.7 mm -55.38 -53.64 33.54 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.653 0 C-N-CA 125.006 1.323 . . . . 0.0 110.684 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -58.14 -32.15 67.89 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 120.125 1.329 . . . . 0.0 114.109 -178.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.73 -45.18 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 120.086 1.312 . . . . 0.0 110.425 173.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.59 -48.06 76.35 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.782 1.233 . . . . 0.0 112.042 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.76 -45.21 78.13 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.964 1.705 . . . . 0.0 111.628 170.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -61.9 -27.09 68.56 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.5 t -76.55 -47.8 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 CA-C-N 120.082 1.31 . . . . 0.0 111.643 166.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -54.91 -32.77 61.43 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 119.561 1.073 . . . . 0.0 113.027 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -57.23 -25.63 59.42 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.061 2.545 . . . . 0.0 115.021 171.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.35 -31.03 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.173 1.389 . . . . 0.0 114.263 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -131.71 76.39 1.71 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.536 1.934 . . . . 0.0 109.423 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.1 p -59.71 -27.02 66.09 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -177.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -128.79 106.64 18.51 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 126.345 1.858 . . . . 0.0 108.452 156.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -82.15 -172.3 1.41 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 124.482 3.455 . . . . 0.0 112.462 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.66 164.81 33.16 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.351 0.977 . . . . 0.0 113.011 167.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 24.9 mm -64.19 -38.17 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 O-C-N 121.753 -0.851 . . . . 0.0 111.636 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.26 -28.07 68.91 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.823 0.849 . . . . 0.0 112.936 176.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 24.6 mm -79.53 -37.93 19.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.474 1.51 . . . . 0.0 110.413 175.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.5 mt -61.44 -49.96 74.72 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 118.659 -0.686 . . . . 0.0 111.134 168.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.08 -46.65 78.95 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.287 1.435 . . . . 0.0 113.38 172.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.04 -38.4 90.74 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.5 mt -65.98 -46.92 76.29 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.652 -0.655 . . . . 0.0 111.311 170.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.05 -47.81 77.21 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.759 1.223 . . . . 0.0 111.951 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -52.41 -69.48 0.11 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.997 1.319 . . . . 0.0 111.561 167.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -66.85 -18.87 65.59 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.711 1.375 . . . . 0.0 114.711 -166.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 73.0 mt -102.34 -2.89 28.04 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.294 1.438 . . . . 0.0 113.455 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 45.74 62.18 2.32 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.169 2.187 . . . . 0.0 112.31 -169.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.536 HD11 HE21 ' A' ' 12' ' ' GLN . 78.6 mt -144.41 114.27 7.29 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 126.613 1.965 . . . . 0.0 109.029 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 pm0 -60.37 150.67 30.02 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 119.353 0.979 . . . . 0.0 113.233 -174.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.8 -33.61 49.77 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 124.629 1.172 . . . . 0.0 113.578 -171.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -55.89 -48.83 74.9 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.728 1.611 . . . . 0.0 112.057 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -62.9 -44.79 95.16 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.482 -1.386 . . . . 0.0 111.706 175.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 34.6 mm -67.29 -35.16 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.659 0.663 . . . . 0.0 111.673 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -57.7 -57.92 10.62 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.22 1.408 . . . . 0.0 111.41 168.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.0 -32.33 49.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.435 1.016 . . . . 0.0 111.627 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -63.07 -56.15 19.37 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.459 -1.4 . . . . 0.0 112.196 171.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -58.62 -42.36 88.02 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 118.983 0.81 . . . . 0.0 111.962 178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -53.85 -55.24 28.51 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.219 1.407 . . . . 0.0 111.055 171.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -73.98 10.9 1.02 Allowed 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.74 -61.03 1.45 Allowed 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.577 1.951 . . . . 0.0 110.141 159.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -45.31 89.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.952 1.301 . . . . 0.0 112.744 -178.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.86 -27.52 64.9 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.346 0.658 . . . . 0.0 112.578 174.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -65.65 -51.92 55.75 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.2 -0.938 . . . . 0.0 110.922 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.2 mp -59.75 -26.9 66.05 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -60.67 -61.63 2.45 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 111.575 168.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.3 ttp85 -78.91 -13.4 59.82 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -174.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.5 t -66.92 169.59 7.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.229 1.412 . . . . 0.0 112.229 176.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -138.67 133.75 32.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.803 1.241 . . . . 0.0 110.031 -178.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.35 93.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.486 1.914 . . . . 0.0 111.949 -161.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -136.85 69.57 1.41 Allowed 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.903 1.681 . . . . 0.0 108.487 176.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.8 p -81.41 55.26 2.55 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.208 -1.558 . . . . 0.0 113.272 -176.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.43 177.74 3.82 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.761 1.624 . . . . 0.0 112.424 168.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -135.32 168.87 18.39 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.911 1.284 . . . . 0.0 111.205 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.8 5.34 5.03 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.883 1.809 . . . . 0.0 115.883 -162.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 20.8 mmt . . . . . 0 C--O 1.247 0.931 0 C-N-CA 125.813 1.645 . . . . 0.0 111.384 173.511 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.274 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 83.1 mtm-85 -146.79 -55.97 0.26 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.826 2.05 . . . . 0.0 113.034 178.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.35 148.87 97.36 Favored Pre-proline 0 N--CA 1.476 0.845 0 C-N-CA 124.523 1.129 . . . . 0.0 111.817 -173.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.49 115.11 3.18 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 121.94 1.76 . . . . 0.0 109.915 158.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.04 147.38 16.42 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.206 -0.934 . . . . 0.0 112.632 166.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.3 m -143.56 -20.62 0.6 Allowed 'General case' 0 N--CA 1.474 0.758 0 O-C-N 124.749 1.281 . . . . 0.0 112.949 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.66 93.65 0.73 Allowed 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.259 -1.526 . . . . 0.0 110.712 160.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -68.36 -166.75 0.07 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.151 2.98 . . . . 0.0 112.666 177.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 5.9 t -72.62 147.19 46.04 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.089 -1.007 . . . . 0.0 111.282 163.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -57.01 -36.87 70.93 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -65.61 -9.06 23.67 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -96.21 -46.12 6.57 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.405 1.882 . . . . 0.0 111.656 162.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mm -52.68 -43.25 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 CA-C-O 118.407 -0.806 . . . . 0.0 112.171 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -60.25 -36.81 78.62 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.69 1.196 . . . . 0.0 113.276 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.2 t -67.86 -48.15 76.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.16 0.891 . . . . 0.0 110.003 175.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.3 mt -62.02 -46.19 90.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.599 1.159 . . . . 0.0 111.839 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.58 -41.67 97.74 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.697 1.199 . . . . 0.0 113.318 171.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.8 -42.28 79.25 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.845 1.657 . . . . 0.0 113.347 172.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 93.9 t -64.13 -50.22 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.411 1.005 . . . . 0.0 111.006 172.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -57.79 -33.93 69.07 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.798 1.639 . . . . 0.0 113.912 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -55.6 -52.45 63.75 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 127.213 2.205 . . . . 0.0 110.713 173.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 51.6 t -72.02 -42.28 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.474 1.51 . . . . 0.0 112.151 178.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -146.16 110.96 5.22 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.688 1.195 . . . . 0.0 112.887 -176.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 82.6 m -57.49 -24.66 57.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.333 1.453 . . . . 0.0 114.779 176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -134.5 92.05 20.92 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.933 1.293 . . . . 0.0 112.237 -174.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -70.16 178.07 5.21 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.587 2.858 . . . . 0.0 113.471 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -109.4 -178.69 21.27 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 126.177 1.846 . . . . 0.0 112.628 169.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 23.5 mm -59.32 -51.68 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.711 0.804 . . . . 0.0 111.414 -173.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -29.89 71.06 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.592 1.157 . . . . 0.0 112.305 -176.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.7 mt -71.74 -43.81 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 123.751 0.82 . . . . 0.0 109.555 174.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.21 -43.94 96.72 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.605 -0.684 . . . . 0.0 111.952 172.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.23 -35.87 80.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.654 1.181 . . . . 0.0 113.901 174.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -61.98 -47.3 85.42 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 120.117 1.326 . . . . 0.0 111.728 169.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.22 -48.44 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.669 0.787 . . . . 0.0 111.243 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.82 -56.03 21.25 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.451 1.1 . . . . 0.0 111.734 172.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -53.76 -23.73 12.8 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.203 1.801 . . . . 0.0 113.623 176.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmmt -107.69 -2.7 19.88 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.976 1.71 . . . . 0.0 115.289 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 56.1 mt -134.5 -13.52 2.3 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -173.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.1 29.22 4.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 126.505 1.922 . . . . 0.0 114.853 177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.3 mt -95.9 166.84 11.59 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.597 1.559 . . . . 0.0 110.985 160.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.07 153.47 21.24 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 122.428 1.108 . . . . 0.0 112.877 159.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.1 tt -51.03 -39.1 55.08 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.237 1.415 . . . . 0.0 113.462 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.03 -41.08 77.95 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.538 1.517 . . . . 0.0 112.834 175.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 ttm-85 -74.99 -30.03 61.06 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.773 -1.204 . . . . 0.0 111.667 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 36.5 mt -73.88 -39.35 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 123.513 0.725 . . . . 0.0 111.588 169.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -51.68 -56.82 11.47 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.816 1.247 . . . . 0.0 111.292 167.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.6 mt -58.61 -34.72 52.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.709 0.804 . . . . 0.0 112.056 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.41 ' CZ2' ' HG3' ' A' ' 52' ' ' ARG . 79.1 t90 -61.92 -57.68 10.83 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.366 1.439 . . . . 0.0 110.953 171.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -58.68 -42.81 89.39 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -55.26 -53.06 60.87 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.338 1.055 . . . . 0.0 111.626 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -61.97 -48.38 80.63 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.949 1.25 . . . . 0.0 111.689 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG3' ' CZ2' ' A' ' 48' ' ' TRP . 2.8 mmt85 -65.68 -35.38 80.61 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.206 -0.934 . . . . 0.0 113.309 -177.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.33 -43.24 67.4 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.106 1.321 . . . . 0.0 111.753 170.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.48 -35.13 67.61 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.9 pttt -124.66 26.18 7.27 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.389 1.476 . . . . 0.0 113.043 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.0 tp -33.51 -47.19 0.21 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.132 2.573 . . . . 0.0 115.836 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -96.25 -9.73 29.64 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.289 1.588 . . . . 0.0 115.289 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 13.0 ptp180 -122.83 114.86 21.06 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 120.372 1.442 . . . . 0.0 113.299 -175.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 34.2 t -158.08 -175.13 5.18 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.0 1.32 . . . . 0.0 111.527 -171.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -58.37 -23.68 57.67 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 120.7 -1.25 . . . . 0.0 112.652 163.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.0 ttt180 28.54 92.88 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.795 1 C-N-CA 131.857 4.063 . . . . 0.0 114.896 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -126.1 -11.94 6.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.674 1.99 . . . . 0.0 113.307 -167.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.6 t -140.61 174.07 10.88 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.18 0.991 . . . . 0.0 113.254 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -136.25 153.03 51.32 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 128.726 2.81 . . . . 0.0 110.245 -170.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -139.09 166.46 24.46 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 178.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.53 -159.27 0.91 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.577 2.351 . . . . 0.0 111.773 -174.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 58.5 ttm . . . . . 0 C--O 1.252 1.197 0 C-N-CA 125.631 1.572 . . . . 0.0 110.852 177.714 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 -62.01 -15.36 43.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 117.081 2.252 . . . . 0.0 117.081 -161.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.6 ttp-105 -137.21 61.17 31.77 Favored Pre-proline 0 N--CA 1.484 1.251 0 CA-C-N 121.453 1.933 . . . . 0.0 114.051 -174.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -68.35 130.51 21.29 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 122.801 2.334 . . . . 0.0 112.153 -175.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -79.64 57.31 2.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.25 1.42 . . . . 0.0 111.494 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.0 m -70.08 76.83 0.5 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.585 1.554 . . . . 0.0 113.913 -168.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -85.19 172.38 11.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.654 1.181 . . . . 0.0 111.731 161.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.513 ' H ' HD11 ' A' ' 13' ' ' ILE . 5.9 m-85 -133.59 -174.3 3.48 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.535 2.734 . . . . 0.0 110.534 176.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.6 t -73.46 145.92 45.36 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.555 1.142 . . . . 0.0 111.504 168.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -55.82 -37.39 68.62 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.567 1.076 . . . . 0.0 113.717 -172.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.6 -27.98 65.16 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 120.447 1.476 . . . . 0.0 112.719 176.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -82.22 -49.8 9.71 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.819 1.247 . . . . 0.0 111.041 169.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.513 HD11 ' H ' ' A' ' 8' ' ' PHE . 20.4 mm -49.93 -46.56 23.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 118.064 -0.97 . . . . 0.0 112.447 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -59.56 -27.88 66.63 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.579 1.081 . . . . 0.0 113.147 -177.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.58 -50.89 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-N 119.8 1.182 . . . . 0.0 110.364 171.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.5 -43.75 93.13 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -56.67 -41.35 77.12 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 120.394 1.452 . . . . 0.0 111.671 170.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -58.12 -38.34 76.31 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.452 1.024 . . . . 0.0 113.661 172.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.5 t -70.96 -45.38 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.177 0.899 . . . . 0.0 111.356 172.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -59.12 -30.1 67.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.502 1.121 . . . . 0.0 113.953 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.7 mtp85 -57.04 -54.94 41.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.543 1.137 . . . . 0.0 112.205 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.5 m -79.5 -31.62 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -131.62 85.54 2.26 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.335 2.254 . . . . 0.0 111.229 -176.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 28.2 p -60.0 -30.72 69.32 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 177.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -129.63 102.83 17.88 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 126.591 1.957 . . . . 0.0 108.106 164.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -78.96 -175.93 3.01 Favored 'Trans proline' 0 CA--C 1.547 1.174 0 C-N-CA 123.914 3.076 . . . . 0.0 112.917 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -101.9 167.68 18.65 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 126.111 1.815 . . . . 0.0 113.201 167.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 33.4 mm -64.82 -35.52 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.498 1.119 . . . . 0.0 112.568 -171.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -64.73 -32.32 73.94 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.139 0.975 . . . . 0.0 112.881 176.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.4 mm -71.72 -37.48 62.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.863 0.865 . . . . 0.0 110.563 172.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 89.9 mt -67.14 -47.68 70.36 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.75 172.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -52.63 -53.65 44.13 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 120.02 1.282 . . . . 0.0 113.399 167.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.95 -42.88 80.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.894 1.679 . . . . 0.0 112.61 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.71 -44.97 95.95 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.114 -0.991 . . . . 0.0 112.689 172.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.44 -58.67 6.78 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.318 1.047 . . . . 0.0 111.395 173.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -53.9 -44.18 70.3 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.11 1.364 . . . . 0.0 112.928 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -86.05 -6.58 59.0 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -175.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.2 mt -121.93 2.95 9.98 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.045 1.338 . . . . 0.0 113.45 -179.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.7 t30 61.0 24.38 14.49 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.049 2.139 . . . . 0.0 114.039 -177.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.7 mt -95.85 173.09 7.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 127.345 2.258 . . . . 0.0 109.868 174.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -111.06 162.48 14.84 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.284 1.033 . . . . 0.0 113.337 168.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.6 tp -48.06 -48.07 33.47 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.504 1.522 . . . . 0.0 112.522 -176.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -60.49 -39.72 88.72 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.379 1.072 . . . . 0.0 112.319 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -61.93 -40.68 96.33 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.885 1.22 . . . . 0.0 111.102 173.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -40.41 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 118.693 0.679 . . . . 0.0 111.23 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.83 -55.62 24.94 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.268 1.027 . . . . 0.0 112.23 169.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.9 mp -60.81 -39.25 81.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.411 175.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -60.66 -50.51 73.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 120.824 1.647 . . . . 0.0 111.797 175.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -65.65 -41.34 92.68 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 118.942 0.792 . . . . 0.0 111.769 178.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -60.4 -40.13 89.84 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.955 1.252 . . . . 0.0 111.997 172.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -56.84 -52.01 66.79 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.799 1.181 . . . . 0.0 111.702 169.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -44.86 94.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.51 -35.11 73.02 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.784 -1.198 . . . . 0.0 111.709 175.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.54 -45.98 91.84 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.704 1.138 . . . . 0.0 111.92 168.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -49.11 -29.09 4.81 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 126.897 2.079 . . . . 0.0 114.667 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.1 mp -68.81 -21.85 64.29 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -143.03 2.94 1.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -148.15 158.59 44.16 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 127.013 2.125 . . . . 0.0 109.24 174.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 26.4 m 62.16 -171.94 0.16 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.65 1.18 . . . . 0.0 112.756 -165.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 53.7 -159.23 0.15 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.744 1.618 . . . . 0.0 112.658 -165.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.41 77.53 1.44 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 126.141 1.776 . . . . 0.0 110.537 -178.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.71 72.89 9.43 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 122.246 1.022 . . . . 0.0 110.725 -171.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.3 m -149.56 175.28 11.66 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.317 1.847 . . . . 0.0 111.575 -177.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -72.4 89.36 1.24 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.135 0.974 . . . . 0.0 111.029 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -60.8 -19.34 59.36 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.63 96.86 0.19 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.966 0.803 . . . . 0.0 109.686 172.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 28.3 ttt . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.607 2.363 . . . . 0.0 111.161 -179.093 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.655 0 CA-C-O 118.606 -1.108 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -156.13 139.92 16.15 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.206 1.403 . . . . 0.0 110.546 172.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -119.59 53.41 2.41 Favored Pre-proline 0 N--CA 1.488 1.456 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -76.23 -177.84 3.98 Favored 'Trans proline' 0 CA--C 1.545 1.034 0 C-N-CA 123.21 2.607 . . . . 0.0 112.593 169.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -118.28 125.3 49.82 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.818 2.047 . . . . 0.0 109.108 174.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.5 m -136.15 138.66 42.2 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.437 0.695 . . . . 0.0 112.02 -170.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -150.21 174.89 12.3 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.096 2.158 . . . . 0.0 110.83 175.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -131.47 -163.36 1.32 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.405 2.282 . . . . 0.0 111.474 -167.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 9.6 t -73.16 150.88 41.8 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.701 0.8 . . . . 0.0 111.197 155.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -68.31 -33.27 74.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -167.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -71.91 -14.89 62.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.581 1.537 . . . . 0.0 113.198 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -78.39 -50.05 12.43 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.908 -1.12 . . . . 0.0 110.446 162.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.414 ' CD1' ' HE1' ' A' ' 48' ' ' TRP . 19.3 mm -48.34 -50.07 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.996 0.918 . . . . 0.0 112.051 175.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -60.6 -25.4 66.21 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -176.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.6 t -69.1 -43.42 81.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-N 120.078 1.308 . . . . 0.0 110.662 172.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 5.0 mp -65.82 -46.58 78.08 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 118.695 -0.669 . . . . 0.0 111.431 174.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -52.9 -47.2 68.12 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 119.716 1.143 . . . . 0.0 113.482 171.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -64.62 -27.2 68.77 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 76.4 t -71.99 -44.42 66.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.263 0.938 . . . . 0.0 111.508 164.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -56.42 -37.11 69.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.33 1.452 . . . . 0.0 113.353 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -69.91 -0.06 6.72 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 172.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 42.2 t -119.05 -37.29 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.069 1.748 . . . . 0.0 111.304 173.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -130.7 88.52 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 127.298 2.239 . . . . 0.0 110.163 -176.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.73 -33.1 75.1 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.94 0.896 . . . . 0.0 112.77 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -122.78 87.97 50.18 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.901 1.68 . . . . 0.0 108.956 165.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -61.58 162.21 21.93 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.699 2.266 . . . . 0.0 114.538 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -81.73 164.08 44.64 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.017 0.818 . . . . 0.0 112.4 162.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 22.1 mm -57.95 -39.1 70.23 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.817 0 C-N-CA 124.73 1.212 . . . . 0.0 111.103 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.31 -29.38 64.96 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.43 1.892 . . . . 0.0 112.972 -176.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.3 mt -69.58 -45.32 78.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 C-N-CA 123.669 0.788 . . . . 0.0 109.168 170.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 14.9 mt -64.0 -43.37 95.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.553 0.741 . . . . 0.0 111.134 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.21 -35.99 80.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.446 1.498 . . . . 0.0 114.244 174.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.32 -44.97 93.42 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 120.706 -1.246 . . . . 0.0 112.05 168.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.0 mt -58.63 -47.84 83.02 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.735 0.698 . . . . 0.0 111.912 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -50.82 -57.81 7.5 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 126.019 1.727 . . . . 0.0 111.189 174.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -44.83 84.43 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.529 0.731 . . . . 0.0 112.587 177.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -75.12 -15.85 60.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.572 1.549 . . . . 0.0 114.656 -177.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 88.8 mt -122.77 -2.82 8.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.671 1.189 . . . . 0.0 114.199 -172.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 55.87 56.28 6.19 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.741 2.016 . . . . 0.0 112.565 -174.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 79.9 mt -131.05 156.45 45.16 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.442 2.297 . . . . 0.0 108.691 176.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pm0 -85.37 154.19 22.03 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.819 0.736 . . . . 0.0 112.574 169.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.35 -47.65 6.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.493 1.917 . . . . 0.0 112.658 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -64.1 -34.73 78.71 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 177.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -64.28 -39.22 93.49 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 121.678 2.035 . . . . 0.0 111.347 173.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -44.92 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.295 -0.86 . . . . 0.0 111.486 174.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -56.28 -54.26 47.5 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.579 1.081 . . . . 0.0 111.396 172.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.8 mp -56.38 -42.33 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 O-C-N 120.559 -1.338 . . . . 0.0 110.739 175.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.421 ' CE2' ' HD2' ' A' ' 52' ' ' ARG . 81.1 t90 -57.08 -55.84 29.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 120.432 1.469 . . . . 0.0 112.492 174.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -61.73 -48.03 82.56 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.82 0.848 . . . . 0.0 112.606 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -59.0 -40.93 86.4 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 120.18 1.355 . . . . 0.0 111.884 174.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -62.59 -38.02 88.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.116 1.326 . . . . 0.0 111.605 172.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HD2' ' CE2' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -63.42 -52.71 60.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.053 0.941 . . . . 0.0 112.744 174.285 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -36.58 84.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.344 1.058 . . . . 0.0 111.71 -179.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.43 -60.54 3.49 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.587 0.63 . . . . 0.0 111.299 164.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 0.3 OUTLIER -53.02 -44.47 67.36 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.083 1.753 . . . . 0.0 114.12 -176.643 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.12 -54.98 40.82 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.966 0.803 . . . . 0.0 110.428 177.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.5 ttmm -64.21 -40.1 95.37 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 118.106 -0.95 . . . . 0.0 113.424 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 53.21 174.8 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.781 2.033 . . . . 0.0 112.87 -164.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 t -144.53 77.07 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.407 1.083 . . . . 0.0 109.234 162.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.602 ' CG ' ' H ' ' A' ' 61' ' ' ARG . 12.6 t-80 60.79 -178.14 0.11 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.844 2.458 . . . . 0.0 114.748 -164.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.602 ' H ' ' CG ' ' A' ' 60' ' ' HIS . 27.9 mtm105 54.71 -172.5 0.05 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 128.794 2.838 . . . . 0.0 112.671 -158.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 50.27 62.17 2.81 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.318 1.847 . . . . 0.0 113.61 -167.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.3 t -149.64 164.86 34.0 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.16 1.384 . . . . 0.0 110.36 170.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.87 132.92 43.0 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.476 0.711 . . . . 0.0 111.83 -174.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 9.9 p90 -145.29 -175.86 4.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.207 1.403 . . . . 0.0 112.369 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp 51.69 -106.36 0.26 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 126.84 2.056 . . . . 0.0 114.539 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 96.0 mtp . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.25 1.82 . . . . 0.0 111.797 -162.95 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.104 0 N-CA-C 109.917 -1.273 . . . . 0.0 109.917 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.7 ptt-85 -126.94 130.13 49.49 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.789 1.294 . . . . 0.0 111.452 179.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.5 mtt180 56.97 168.32 0.06 OUTLIER Pre-proline 0 CA--C 1.559 1.312 0 C-N-CA 125.601 1.56 . . . . 0.0 113.732 -167.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -78.25 -175.41 2.7 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 123.585 2.857 . . . . 0.0 113.873 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 47.94 83.02 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 127.066 2.147 . . . . 0.0 113.039 172.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.6 m -73.32 129.78 38.76 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.951 -1.093 . . . . 0.0 110.947 169.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -139.59 167.52 21.92 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.075 1.35 . . . . 0.0 110.937 166.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -130.48 -174.83 3.46 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 125.451 1.501 . . . . 0.0 113.21 -169.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.6 p -79.52 151.31 30.82 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 127.383 2.273 . . . . 0.0 111.285 171.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -56.75 -45.24 82.14 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.729 1.381 . . . . 0.0 114.729 -167.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -61.24 -21.38 63.82 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 121.578 1.99 . . . . 0.0 113.633 178.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -85.12 -38.59 18.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.794 1.238 . . . . 0.0 112.133 169.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.432 HD12 ' HE1' ' A' ' 48' ' ' TRP . 37.7 mm -57.7 -50.95 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.748 0.819 . . . . 0.0 111.392 171.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -66.05 -19.05 65.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -176.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 87.7 t -78.21 -42.77 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 120.384 -1.447 . . . . 0.0 110.653 167.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 71.8 mt -67.96 -48.91 64.55 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.488 1.115 . . . . 0.0 112.337 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -55.9 -40.52 73.17 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.768 1.227 . . . . 0.0 112.074 167.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -63.22 -25.35 68.29 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.189 1.181 . . . . 0.0 114.189 174.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.3 t -79.59 -45.28 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.922 1.237 . . . . 0.0 111.215 165.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -53.9 -41.97 68.21 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.624 1.102 . . . . 0.0 112.964 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.35 -6.36 23.91 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 175.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 61.0 t -110.58 -38.16 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.739 2.016 . . . . 0.0 111.303 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -141.36 97.41 3.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.107 2.163 . . . . 0.0 109.307 172.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 16.6 p -55.48 -33.21 63.48 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.936 0.894 . . . . 0.0 112.755 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -121.96 103.65 39.57 Favored Pre-proline 0 CA--C 1.543 0.679 0 C-N-CA 125.66 1.584 . . . . 0.0 109.39 161.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -73.64 179.93 5.13 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 124.201 3.267 . . . . 0.0 112.791 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.68 165.14 41.96 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 121.586 -0.696 . . . . 0.0 111.633 171.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 18.9 mm -68.13 -36.36 75.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 118.595 1.198 . . . . 0.0 110.659 177.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -58.99 -36.32 74.71 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 170.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.1 mt -73.47 -38.72 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 CA-C-N 118.65 0.659 . . . . 0.0 110.378 175.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.17 -46.73 85.75 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 121.291 -0.88 . . . . 0.0 111.867 171.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.09 -51.12 67.39 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.749 1.619 . . . . 0.0 112.833 168.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -61.15 -41.62 97.08 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.412 1.005 . . . . 0.0 112.906 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.4 mt -62.89 -45.83 90.68 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.572 0.749 . . . . 0.0 111.537 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.86 -53.07 62.16 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.062 0.945 . . . . 0.0 110.865 175.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -53.49 -40.45 65.35 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.822 1.649 . . . . 0.0 113.278 177.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.76 -12.74 18.1 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -174.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 94.1 mt -99.69 -4.84 29.92 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.37 1.068 . . . . 0.0 112.634 172.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 56.62 55.83 6.07 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.023 1.329 . . . . 0.0 110.819 -172.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.9 mt -126.11 177.8 6.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.981 2.112 . . . . 0.0 109.333 171.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 44' ' ' ARG . 2.9 pm0 -104.1 162.06 13.48 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 120.865 -1.147 . . . . 0.0 112.655 161.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.81 -50.37 7.86 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.861 2.064 . . . . 0.0 112.0 173.117 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -58.64 -47.63 83.78 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.804 1.641 . . . . 0.0 114.126 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.416 ' H ' ' HG2' ' A' ' 41' ' ' GLU . 47.2 mtt180 -63.94 -36.8 85.16 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 120.802 -1.186 . . . . 0.0 111.587 179.108 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.34 -42.09 50.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-O 118.512 -0.756 . . . . 0.0 112.313 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -52.13 -52.11 53.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.505 1.048 . . . . 0.0 111.434 169.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 83.1 mt -59.1 -43.59 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 117.655 -1.164 . . . . 0.0 110.714 175.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.432 ' HE1' HD12 ' A' ' 13' ' ' ILE . 76.1 t90 -57.7 -55.1 39.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.959 1.709 . . . . 0.0 112.48 173.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -59.06 -46.57 87.92 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.342 0.973 . . . . 0.0 111.918 -177.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -65.04 -42.11 94.58 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.444 -0.785 . . . . 0.0 112.149 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -61.21 -38.33 86.22 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.391 1.451 . . . . 0.0 112.227 171.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.407 ' HA ' ' HE ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -58.8 -58.3 9.22 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.596 1.158 . . . . 0.0 112.929 173.493 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -41.33 84.16 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 119.749 1.159 . . . . 0.0 111.738 177.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -48.88 78.14 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 172.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.28 -44.63 94.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.941 1.297 . . . . 0.0 112.139 179.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.26 -28.31 69.94 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -175.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.6 pttm -86.16 -0.86 56.7 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 168.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 13.29 84.57 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 130.952 3.701 . . . . 0.0 114.217 -167.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.1 m -54.66 138.17 42.18 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.614 1.565 . . . . 0.0 112.084 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -149.65 175.14 11.82 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.868 1.667 . . . . 0.0 109.44 159.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -154.45 -177.61 6.58 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.975 2.11 . . . . 0.0 108.657 174.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -50.59 105.91 0.11 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.368 1.867 . . . . 0.0 113.932 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.9 t -147.18 169.67 18.85 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 126.016 1.726 . . . . 0.0 109.407 156.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -149.05 156.11 41.75 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.386 1.874 . . . . 0.0 109.836 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -79.54 -7.74 58.68 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 170.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.4 tp 44.77 -123.04 0.96 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.289 2.236 . . . . 0.0 111.12 -166.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.8 ptm . . . . . 0 C--O 1.251 1.166 0 C-N-CA 129.358 3.063 . . . . 0.0 108.811 176.522 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.131 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -146.1 17.42 1.39 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.722 1.209 . . . . 0.0 114.212 -175.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -112.87 86.55 9.03 Favored Pre-proline 0 N--CA 1.479 0.982 0 C-N-CA 125.478 1.511 . . . . 0.0 111.027 -176.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.77 72.43 4.5 Favored 'Trans proline' 0 CA--C 1.544 1.015 0 C-N-CA 124.084 3.19 . . . . 0.0 113.301 -169.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 -100.29 137.48 38.66 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.603 1.561 . . . . 0.0 109.384 168.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 m -147.31 125.58 12.25 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.382 -0.824 . . . . 0.0 111.218 172.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.33 168.54 19.43 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.135 1.374 . . . . 0.0 110.918 168.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -127.66 -169.57 2.07 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.425 2.29 . . . . 0.0 110.5 -172.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.0 t -62.65 144.39 56.32 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 121.338 -0.851 . . . . 0.0 109.938 158.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -56.05 -34.47 65.93 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.732 1.213 . . . . 0.0 112.909 176.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -70.72 -1.31 11.01 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 126.177 1.791 . . . . 0.0 113.991 173.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -104.25 -48.88 3.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.613 1.565 . . . . 0.0 110.116 159.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.5 mm -46.52 -46.06 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 124.627 1.171 . . . . 0.0 112.571 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -53.13 -38.08 62.36 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 176.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.3 t -66.22 -49.09 78.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 120.357 1.435 . . . . 0.0 109.985 176.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.24 -45.45 93.2 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.14 0.576 . . . . 0.0 112.55 176.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -61.16 -45.08 96.11 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 120.83 -1.169 . . . . 0.0 114.087 172.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -64.5 -25.82 68.16 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 120.65 1.568 . . . . 0.0 113.443 176.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.6 t -70.34 -53.56 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 120.254 1.388 . . . . 0.0 110.841 165.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -54.83 -30.46 57.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.91 1.284 . . . . 0.0 113.604 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -62.05 -23.12 66.29 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 128.325 2.65 . . . . 0.0 114.389 173.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.9 t -119.53 -30.26 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.91 1.684 . . . . 0.0 112.104 -173.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -142.77 96.99 3.02 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.317 1.447 . . . . 0.0 110.27 165.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 26.5 p -70.64 -8.28 50.58 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -178.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -145.77 76.2 12.88 Favored Pre-proline 0 CA--C 1.548 0.882 0 CA-C-N 119.334 0.97 . . . . 0.0 111.29 174.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -79.35 -173.38 1.85 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.108 3.205 . . . . 0.0 114.006 -170.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -94.89 173.33 31.85 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.46 1.505 . . . . 0.0 113.74 174.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.56 -41.37 92.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 C-N-CA 123.806 0.842 . . . . 0.0 111.988 -175.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.43 -36.95 72.04 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.972 0.909 . . . . 0.0 112.912 176.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.426 ' N ' HD12 ' A' ' 30' ' ' ILE . 1.7 mp -68.17 -42.15 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 119.106 0.866 . . . . 0.0 110.072 174.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 67.4 mt -62.55 -46.29 89.04 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 118.869 -0.586 . . . . 0.0 112.214 173.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -62.88 -43.8 97.82 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.776 1.631 . . . . 0.0 113.964 175.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.73 -35.54 81.41 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 120.275 1.398 . . . . 0.0 112.003 175.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 70.5 mt -66.11 -50.4 64.16 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.271 -0.893 . . . . 0.0 111.89 169.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.45 -43.37 71.59 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.382 1.473 . . . . 0.0 112.252 177.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -56.29 -69.08 0.16 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.752 1.221 . . . . 0.0 112.016 167.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -69.08 -15.15 63.38 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -168.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.0 mt -120.71 3.48 10.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.976 1.311 . . . . 0.0 114.376 -176.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.77 71.92 0.48 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.993 2.117 . . . . 0.0 113.716 178.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.8 mt -141.38 165.7 26.78 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.95 2.1 . . . . 0.0 109.643 170.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.24 147.11 31.36 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.888 -1.133 . . . . 0.0 112.077 158.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.7 tt -49.99 -35.54 24.89 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.989 0.916 . . . . 0.0 113.199 172.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -55.76 -42.2 75.11 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 112.381 174.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -74.97 -32.12 61.63 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.173 -0.955 . . . . 0.0 113.319 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 4.1 mm -66.72 -39.86 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 CA-C-N 119.543 1.065 . . . . 0.0 111.298 168.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -57.81 -58.67 7.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 124.958 1.303 . . . . 0.0 110.716 171.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.5 mt -54.1 -38.51 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 CA-C-N 119.524 1.056 . . . . 0.0 111.469 175.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.66 -59.45 5.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 120.193 1.36 . . . . 0.0 112.956 172.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -58.96 -43.39 91.3 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.139 0.882 . . . . 0.0 111.959 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -64.43 -42.87 95.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 111.644 177.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -62.54 -38.43 89.97 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.645 1.566 . . . . 0.0 111.713 172.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -61.54 2.36 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.544 1.138 . . . . 0.0 112.328 173.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -37.41 86.4 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.491 -0.766 . . . . 0.0 112.02 -178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -63.52 -45.97 88.16 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.324 0.965 . . . . 0.0 112.852 172.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -70.77 -34.11 71.48 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 120.96 -1.087 . . . . 0.0 113.116 -177.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.1 tt -50.02 -37.06 31.2 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.877 1.271 . . . . 0.0 112.713 177.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.1 tttp -74.92 -33.95 62.07 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.009 1.723 . . . . 0.0 114.453 177.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -129.83 68.26 1.44 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.664 1.986 . . . . 0.0 111.778 -175.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 34.6 t -159.94 152.8 21.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.114 1.366 . . . . 0.0 109.821 168.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.9 t60 61.37 166.43 0.09 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.778 2.431 . . . . 0.0 114.075 -168.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -151.46 -16.11 0.2 Allowed 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 176.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -65.95 145.29 56.07 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 120.096 1.316 . . . . 0.0 111.861 168.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.8 t -127.9 91.38 3.27 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.929 0.892 . . . . 0.0 111.908 -159.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.9 91.99 0.89 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.774 1.629 . . . . 0.0 113.342 -174.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -113.33 155.27 25.46 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.883 1.673 . . . . 0.0 110.565 165.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -93.35 -93.16 0.16 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.441 1.096 . . . . 0.0 111.331 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 25.4 ttt . . . . . 0 C--O 1.252 1.195 0 C-N-CA 127.916 2.487 . . . . 0.0 109.436 -176.447 . . . . . . . . 0 0 . 1 stop_ save_