data_1zdc_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 1zdc _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 ' 9' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 . . . . . 0 CA--C 1.53 0.184 0 N-CA-C 110.686 -0.116 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.9 m -66.24 -45.0 82.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.077 0.951 . . . . 0.0 110.041 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -54.85 -53.83 50.22 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.08 0.952 . . . . 0.0 110.52 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -60.62 -43.55 97.35 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.689 0.796 . . . . 0.0 111.389 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.4 mtp85 -60.6 -45.48 93.84 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.466 0.706 . . . . 0.0 111.206 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -59.19 -52.58 65.07 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.278 0.49 . . . . 0.0 110.296 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -53.85 -48.74 69.68 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.17 0.988 . . . . 0.0 111.096 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -59.15 -53.28 60.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.645 0.778 . . . . 0.0 110.786 176.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.25 77.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.252 1.021 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.42 -53.84 52.69 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.411 0.685 . . . . 0.0 109.708 173.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -89.99 59.72 4.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.612 0.765 . . . . 0.0 110.136 -174.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -133.21 81.33 56.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.698 0.799 . . . . 0.0 110.226 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -54.78 -29.03 60.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 124.541 3.494 . . . . 0.0 114.125 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -58.72 -32.74 69.47 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.86 0.864 . . . . 0.0 111.594 -178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.6 mt -89.47 153.34 20.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.65 0.78 . . . . 0.0 109.393 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -89.53 -177.65 5.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.35 -51.43 69.44 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.541 0.736 . . . . 0.0 111.431 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -61.04 -51.95 67.02 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.899 0.88 . . . . 0.0 110.383 -174.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.87 -50.85 69.5 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.692 1.197 . . . . 0.0 110.883 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -59.24 -51.4 70.13 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.896 0.878 . . . . 0.0 111.06 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -59.13 -40.09 84.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.093 0.557 . . . . 0.0 111.362 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.654 0.382 . . . . 0.0 111.086 174.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -62.89 -50.7 69.86 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 109.96 178.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.2 mm -53.92 -48.81 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.277 1.031 . . . . 0.0 109.978 175.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -58.0 -43.41 86.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.871 0.869 . . . . 0.0 111.093 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -61.89 -47.18 86.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.36 0.664 . . . . 0.0 111.286 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.2 mt -57.41 -50.76 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -62.1 -43.24 99.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.875 0.87 . . . . 0.0 111.723 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.14 -51.45 69.01 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.919 0.888 . . . . 0.0 110.604 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.99 -52.78 64.31 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.316 1.046 . . . . 0.0 111.392 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.2 m . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 124.6 1.16 . . . . 0.0 112.347 -175.343 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 tm0? . . . . . 0 N--CA 1.454 -0.247 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.8 m -59.54 -44.64 93.16 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.803 0.841 . . . . 0.0 109.57 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -49.92 -51.85 37.75 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.521 1.128 . . . . 0.0 111.265 173.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -65.03 -40.25 94.57 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.48 0.712 . . . . 0.0 110.893 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -61.4 -48.29 81.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.252 0.621 . . . . 0.0 110.881 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -57.13 -50.14 73.72 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.229 0.612 . . . . 0.0 110.744 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -57.12 -52.36 65.6 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.08 0.952 . . . . 0.0 110.882 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -55.68 -54.03 49.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.683 0.793 . . . . 0.0 110.751 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.6 -47.63 76.2 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.053 0.941 . . . . 0.0 111.354 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 tp -55.39 -39.25 69.92 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.538 1.135 . . . . 0.0 111.382 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -103.01 20.9 16.7 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.606 0.762 . . . . 0.0 111.987 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -80.16 119.64 77.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 118.697 0.681 . . . . 0.0 110.132 -176.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.18 -28.69 2.3 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.346 2.697 . . . . 0.0 112.128 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -60.87 -41.07 95.25 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.67 1.188 . . . . 0.0 112.076 -172.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.22 162.41 15.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.018 0.927 . . . . 0.0 110.086 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -89.85 -179.47 5.74 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.714 0.806 . . . . 0.0 108.983 169.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.94 -50.15 67.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -60.61 -55.48 32.79 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.045 0.538 . . . . 0.0 111.345 -173.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.02 -36.82 84.3 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.82 0.448 . . . . 0.0 111.36 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.2 ttp-105 -60.88 -49.26 78.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.932 0.493 . . . . 0.0 110.762 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -60.64 -39.39 88.1 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.176 0.59 . . . . 0.0 110.949 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.65 -38.68 88.63 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 117.962 0.347 . . . . 0.0 111.125 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -64.83 -49.81 69.14 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.794 0.838 . . . . 0.0 109.971 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.0 mm -52.84 -47.31 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.408 1.083 . . . . 0.0 110.178 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -59.44 -46.76 87.83 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.452 0.701 . . . . 0.0 110.833 178.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -59.01 -44.57 91.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 111.402 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.41 -47.91 86.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.2 ttm105 -60.34 -42.55 95.93 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.947 0.499 . . . . 0.0 111.888 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -61.98 -48.98 77.92 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.29 0.636 . . . . 0.0 110.461 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -60.51 -54.29 47.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.387 1.075 . . . . 0.0 111.407 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 96.9 m . . . . . 0 N--CA 1.455 -0.201 0 C-N-CA 124.562 1.145 . . . . 0.0 111.65 -173.343 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 CA--C 1.529 0.144 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.3 m -61.24 -43.9 98.12 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.21 1.004 . . . . 0.0 109.568 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.64 -44.66 96.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.887 0.875 . . . . 0.0 110.952 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -61.16 -46.93 88.51 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.966 0.906 . . . . 0.0 110.618 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -60.55 -46.05 91.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.689 1.196 . . . . 0.0 110.871 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -58.5 -52.95 63.49 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.738 0.415 . . . . 0.0 110.462 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -56.33 -48.25 77.12 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.08 0.952 . . . . 0.0 111.138 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.98 -59.02 5.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.099 0.96 . . . . 0.0 110.346 177.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -47.18 73.34 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.208 1.003 . . . . 0.0 111.716 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 43.4 tp -55.52 -29.28 58.59 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.381 1.472 . . . . 0.0 112.466 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -116.3 16.38 15.79 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.87 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -77.39 119.54 77.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-O 118.669 -0.682 . . . . 0.0 109.647 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.63 -37.18 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.986 2.457 . . . . 0.0 111.814 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -63.71 -38.76 92.31 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.304 1.042 . . . . 0.0 111.399 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -89.15 137.22 32.52 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -89.08 -173.34 4.02 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.55 0.74 . . . . 0.0 109.313 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.59 -42.83 79.37 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.864 0.465 . . . . 0.0 112.115 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.02 -57.01 12.13 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.683 0.793 . . . . 0.0 110.309 -177.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.75 -44.24 93.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.048 0.939 . . . . 0.0 110.924 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -55.36 -56.13 23.66 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.309 1.043 . . . . 0.0 110.109 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.67 -43.05 75.96 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.381 0.673 . . . . 0.0 111.255 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.51 -38.15 80.17 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.94 0.496 . . . . 0.0 111.416 174.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -66.13 -50.37 64.21 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.929 0.892 . . . . 0.0 110.534 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.0 mm -57.74 -41.12 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.093 0.557 . . . . 0.0 109.932 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -61.54 -46.19 90.97 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.261 0.624 . . . . 0.0 111.481 176.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.7 p -63.13 -42.03 99.42 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.172 0.442 . . . . 0.0 111.358 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 54.5 mt -63.79 -53.0 50.01 Favored 'Isoleucine or valine' 0 C--N 1.342 0.253 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -61.97 -38.79 89.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.277 0.49 . . . . 0.0 111.153 -175.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.77 -53.46 53.99 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.855 0.862 . . . . 0.0 110.805 175.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.6 -55.98 27.14 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.912 1.285 . . . . 0.0 111.408 -178.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.9 m . . . . . 0 N--CA 1.453 -0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 111.763 -175.154 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -60.19 -52.13 66.61 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.865 0.866 . . . . 0.0 110.328 175.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -51.05 -50.11 59.25 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.507 1.123 . . . . 0.0 111.389 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 51.7 ttm-85 -55.2 -51.65 65.87 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.576 1.151 . . . . 0.0 110.698 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.95 -42.25 97.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.049 0.54 . . . . 0.0 111.733 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -59.75 -51.4 69.93 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.509 0.595 . . . . 0.0 110.14 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -55.76 -48.66 74.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.308 1.043 . . . . 0.0 111.031 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.99 -55.33 34.09 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.568 0.747 . . . . 0.0 110.221 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.84 -48.13 78.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.377 1.071 . . . . 0.0 111.77 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.77 -41.21 61.45 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.763 0.825 . . . . 0.0 110.926 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -103.22 54.7 0.76 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.114 0.966 . . . . 0.0 109.992 -177.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -129.43 81.88 69.01 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 123.833 0.853 . . . . 0.0 110.166 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.17 -37.25 38.54 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 125.04 3.826 . . . . 0.0 114.281 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -56.64 -35.0 67.86 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.194 0.998 . . . . 0.0 111.884 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.5 mt -89.57 138.41 31.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -88.83 -177.04 5.41 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -51.96 -47.68 64.69 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -61.51 -60.4 3.76 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.422 0.689 . . . . 0.0 110.615 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -58.21 -44.8 88.33 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.517 0.727 . . . . 0.0 111.14 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -62.31 -50.7 70.6 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.954 0.902 . . . . 0.0 110.397 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.4 -41.35 84.73 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.878 0.471 . . . . 0.0 110.956 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.05 89.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.809 0.444 . . . . 0.0 111.174 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -62.83 -50.59 70.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.917 0.887 . . . . 0.0 110.016 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 32.7 mm -53.96 -49.56 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 123.848 0.859 . . . . 0.0 109.875 175.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -56.54 -47.23 79.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.518 0.727 . . . . 0.0 110.954 179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -58.11 -47.82 82.09 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.637 0.775 . . . . 0.0 111.446 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 51.6 mt -58.33 -48.41 85.08 Favored 'Isoleucine or valine' 0 C--N 1.341 0.234 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -63.91 -34.54 78.18 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.441 0.696 . . . . 0.0 112.126 -175.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -66.88 -51.39 56.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.461 0.705 . . . . 0.0 109.9 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.05 -47.38 74.88 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.599 1.16 . . . . 0.0 111.391 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.8 m . . . . . 0 N--CA 1.454 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.787 -175.772 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -61.68 -50.09 73.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.774 0.43 . . . . 0.0 111.292 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -36.07 80.1 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -62.75 -50.86 69.39 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.301 0.64 . . . . 0.0 109.618 176.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -58.57 -43.99 89.57 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.382 0.673 . . . . 0.0 111.242 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -55.38 -54.06 48.39 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 118.697 0.681 . . . . 0.0 110.283 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -54.03 -58.81 5.91 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.125 0.97 . . . . 0.0 111.384 -175.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.69 -40.03 95.84 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.23 99.1 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.216 0.607 . . . . 0.0 111.348 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -51.09 71.09 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -89.34 49.03 1.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.588 0.755 . . . . 0.0 110.494 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -117.88 98.95 52.01 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 124.417 1.087 . . . . 0.0 108.587 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.45 -23.97 14.53 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.09 2.526 . . . . 0.0 112.019 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -61.34 -37.01 81.74 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.899 0.879 . . . . 0.0 110.655 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.28 146.66 24.58 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.179 0.992 . . . . 0.0 108.761 177.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -89.32 -177.29 5.34 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -57.85 -46.07 85.34 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.065 0.946 . . . . 0.0 111.467 -176.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -57.94 -57.79 11.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.349 0.66 . . . . 0.0 110.276 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.47 -47.67 75.74 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.129 0.972 . . . . 0.0 110.929 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm105 -55.1 -57.57 11.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.768 1.227 . . . . 0.0 110.511 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -59.08 -39.37 81.95 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.943 0.497 . . . . 0.0 111.597 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.67 91.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.215 0.461 . . . . 0.0 111.244 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -65.23 -48.59 72.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.021 0.928 . . . . 0.0 109.87 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -55.68 -46.35 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.641 0.777 . . . . 0.0 110.143 175.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -58.13 -43.6 87.33 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.226 0.61 . . . . 0.0 111.021 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -60.4 -48.28 82.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.921 0.488 . . . . 0.0 111.192 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.74 -46.27 96.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 123.334 0.654 . . . . 0.0 110.179 178.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -62.75 -31.56 72.53 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.326 1.05 . . . . 0.0 111.509 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.23 -44.46 62.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.275 0.63 . . . . 0.0 109.925 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.81 -51.86 67.86 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.161 0.984 . . . . 0.0 110.661 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.19 0 C-N-CA 122.793 0.437 . . . . 0.0 110.803 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 . . . . . 0 CA--C 1.529 0.14 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.4 m -63.0 -44.0 97.23 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.857 0.463 . . . . 0.0 111.169 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.97 -55.97 19.53 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.36 1.064 . . . . 0.0 111.188 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -60.81 -45.35 94.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.872 0.869 . . . . 0.0 110.682 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -65.18 -37.12 86.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.765 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.36 -55.09 39.17 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.022 0.828 . . . . 0.0 109.659 174.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -52.26 -53.7 40.57 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.237 1.015 . . . . 0.0 110.517 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -54.25 -57.18 12.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.596 0.759 . . . . 0.0 110.804 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.1 -45.54 71.86 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.977 0.911 . . . . 0.0 111.912 -177.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.39 -47.13 63.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.828 1.251 . . . . 0.0 110.487 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -89.33 -19.81 24.82 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.599 0.76 . . . . 0.0 112.246 -173.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.74 117.85 24.18 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.421 1.089 . . . . 0.0 111.316 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -82.73 -24.66 3.33 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.557 2.838 . . . . 0.0 112.069 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -58.93 -38.72 79.62 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.474 1.11 . . . . 0.0 111.754 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -89.13 147.94 23.94 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -89.13 -179.74 5.96 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.628 0.771 . . . . 0.0 108.954 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.05 -48.64 61.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.516 0.726 . . . . 0.0 111.774 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -60.36 -58.63 7.7 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.91 0.884 . . . . 0.0 110.719 -175.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -66.32 -33.13 75.03 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.485 0.714 . . . . 0.0 111.834 -177.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -66.51 -48.7 68.94 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.844 0.857 . . . . 0.0 110.564 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.27 -39.49 94.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.153 0.433 . . . . 0.0 110.834 176.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.25 -42.98 96.47 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.72 0.408 . . . . 0.0 111.079 175.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.76 -50.95 71.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.084 0.954 . . . . 0.0 110.264 176.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.7 mm -52.28 -51.05 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.089 0.555 . . . . 0.0 110.003 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.7 -43.77 85.41 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.43 0.692 . . . . 0.0 111.527 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -59.13 -47.49 85.09 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.996 0.519 . . . . 0.0 110.751 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.6 mt -64.12 -42.55 95.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.422 0.689 . . . . 0.0 110.21 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -58.32 -39.31 79.07 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.004 0.521 . . . . 0.0 110.887 174.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.59 -41.39 72.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.552 0.741 . . . . 0.0 110.495 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -54.78 -57.07 13.02 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.455 1.102 . . . . 0.0 111.013 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 57.2 m . . . . . 0 C--N 1.34 0.168 0 CA-C-N 117.661 0.209 . . . . 0.0 111.043 179.26 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.0 m -62.35 -46.92 86.51 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.69 0.396 . . . . 0.0 109.95 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -60.49 -47.65 85.22 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 122.888 0.475 . . . . 0.0 111.413 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -55.21 -49.6 71.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.679 1.191 . . . . 0.0 110.616 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.21 -40.69 96.58 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.792 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -58.54 -52.74 64.38 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.909 0.777 . . . . 0.0 110.437 176.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -54.93 -52.4 63.07 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.54 1.136 . . . . 0.0 110.687 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.28 -55.82 27.08 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.54 0.736 . . . . 0.0 110.071 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.0 -46.43 71.74 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 111.561 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.02 -50.1 48.59 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.243 1.017 . . . . 0.0 109.966 177.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.01 3.08 54.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.935 0.894 . . . . 0.0 113.031 -175.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -73.21 122.06 86.69 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 119.008 0.822 . . . . 0.0 110.89 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -80.15 -28.47 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.256 2.637 . . . . 0.0 112.037 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -60.55 -47.07 87.82 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.185 0.994 . . . . 0.0 111.769 -171.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.9 mt -89.49 150.27 22.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.72 0.808 . . . . 0.0 109.541 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -89.46 -174.76 4.48 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.01 0.924 . . . . 0.0 109.274 175.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -51.39 -52.7 43.65 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.556 1.142 . . . . 0.0 111.911 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -65.69 -51.1 62.04 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.41 0.684 . . . . 0.0 111.054 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.75 -33.88 74.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.229 0.611 . . . . 0.0 111.251 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -61.2 -50.2 74.09 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.067 0.547 . . . . 0.0 109.794 172.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.43 -40.63 95.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.545 0.338 . . . . 0.0 111.006 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.14 -46.72 85.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.646 0.778 . . . . 0.0 110.856 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -59.07 -52.54 65.29 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.547 0.739 . . . . 0.0 110.113 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.0 mm -51.48 -58.17 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.84 0.856 . . . . 0.0 110.875 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.23 -35.7 81.69 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.7 p -63.89 -45.59 88.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.357 0.526 . . . . 0.0 110.668 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 39.8 mt -59.76 -48.04 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 119.013 -0.517 . . . . 0.0 109.635 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 41.3 mtm105 -57.89 -37.73 74.52 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.758 0.708 . . . . 0.0 111.934 177.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -67.05 -49.38 65.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.968 0.507 . . . . 0.0 109.868 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.27 -48.76 80.42 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.378 1.071 . . . . 0.0 111.131 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.3 m . . . . . 0 CA--C 1.53 0.184 0 C-N-CA 125.139 1.376 . . . . 0.0 111.813 -177.353 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 . . . . . 0 C--O 1.226 -0.148 0 N-CA-C 111.318 0.118 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.5 m -53.67 -37.95 63.68 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.741 1.216 . . . . 0.0 112.225 177.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -61.38 -45.21 95.31 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.77 -34.06 73.25 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.393 0.677 . . . . 0.0 110.785 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -63.29 -49.24 74.8 Favored 'General case' 0 C--N 1.341 0.224 0 C-N-CA 123.529 0.732 . . . . 0.0 110.135 173.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -59.14 -46.09 89.27 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.691 0.396 . . . . 0.0 111.151 176.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -57.31 -50.68 72.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.441 1.097 . . . . 0.0 110.681 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.91 -52.34 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.567 0.747 . . . . 0.0 110.686 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.67 -42.63 75.39 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.37 1.068 . . . . 0.0 111.597 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.55 -51.96 67.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.688 0.795 . . . . 0.0 110.005 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -91.57 62.98 4.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.777 0.831 . . . . 0.0 110.22 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -133.62 83.02 49.5 Favored Pre-proline 0 CA--C 1.536 0.44 0 C-N-CA 123.685 0.794 . . . . 0.0 109.47 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.38 -29.09 29.47 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 124.777 3.652 . . . . 0.0 114.798 -178.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -59.45 -29.68 67.97 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.794 0.838 . . . . 0.0 112.241 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.7 mt -89.51 165.1 14.5 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.338 0.655 . . . . 0.0 110.169 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.68 -165.58 1.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.215 1.006 . . . . 0.0 109.281 169.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -47.01 -75.81 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.293 1.437 . . . . 0.0 113.526 -170.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -60.51 -40.44 91.45 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -57.17 -52.83 63.75 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.943 0.897 . . . . 0.0 110.882 176.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.5 ttm-85 -61.06 -52.6 64.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.958 0.903 . . . . 0.0 110.313 -178.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -56.55 -42.56 78.76 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.908 0.483 . . . . 0.0 111.194 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.79 85.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.11 0.564 . . . . 0.0 111.436 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -62.12 -48.34 80.59 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.704 0.802 . . . . 0.0 109.841 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.88 -37.26 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.661 0.784 . . . . 0.0 110.297 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -61.73 -52.0 66.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.083 0.953 . . . . 0.0 110.327 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -59.15 -43.11 92.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.683 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.8 mt -60.58 -47.04 94.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 118.479 0.581 . . . . 0.0 109.931 176.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -55.13 -39.81 69.83 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 118.529 0.604 . . . . 0.0 111.904 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -67.64 -49.07 64.75 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 118.164 0.438 . . . . 0.0 110.14 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -60.36 -49.98 75.42 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.483 1.113 . . . . 0.0 111.248 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m . . . . . 0 N--CA 1.456 -0.155 0 C-N-CA 124.585 1.154 . . . . 0.0 111.472 -174.635 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 . . . . . 0 CA--C 1.532 0.266 0 CA-C-O 119.414 -0.326 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.12 -55.47 33.43 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.532 0.605 . . . . 0.0 109.787 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -60.9 -37.9 83.84 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.502 0.721 . . . . 0.0 111.904 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -61.06 -49.72 76.2 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.54 0.736 . . . . 0.0 109.987 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.56 -37.2 86.01 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.536 0.735 . . . . 0.0 111.523 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -58.85 -54.77 43.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.771 0.714 . . . . 0.0 110.248 174.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -55.86 -49.04 74.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.941 1.296 . . . . 0.0 111.066 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -55.69 -53.43 56.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.829 1.252 . . . . 0.0 110.802 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.61 87.43 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.339 1.056 . . . . 0.0 111.478 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.35 -48.18 74.62 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.491 0.717 . . . . 0.0 109.316 175.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -94.68 41.74 1.09 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.81 0.844 . . . . 0.0 111.17 -177.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -117.77 90.47 36.28 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.215 1.006 . . . . 0.0 108.523 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.74 -25.57 20.28 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.042 2.494 . . . . 0.0 112.01 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -60.3 -35.79 76.39 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.778 0.831 . . . . 0.0 110.972 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.2 mt -89.37 140.01 29.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -89.08 -175.4 4.8 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.405 0.682 . . . . 0.0 109.658 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -51.42 -50.0 60.53 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.938 0.895 . . . . 0.0 111.471 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.4 -54.37 37.77 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.209 0.604 . . . . 0.0 111.199 -174.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -59.76 -45.33 92.57 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.63 0.772 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -57.54 -56.53 20.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.003 0.921 . . . . 0.0 110.241 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.64 -42.38 88.15 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.581 . . . . 0.0 111.179 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.07 -48.16 82.59 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.973 0.509 . . . . 0.0 110.97 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.44 -50.49 73.52 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.927 0.891 . . . . 0.0 110.692 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.8 mm -51.74 -52.72 20.4 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.146 0.978 . . . . 0.0 110.025 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -56.57 -49.1 75.86 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.166 0.586 . . . . 0.0 111.468 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -54.26 -51.51 64.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.985 0.514 . . . . 0.0 111.219 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.6 mt -60.03 -45.52 95.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.226 0.611 . . . . 0.0 110.053 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -57.55 -39.61 77.03 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 123.22 0.608 . . . . 0.0 111.685 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -69.2 -46.16 68.14 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.752 0.421 . . . . 0.0 109.883 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -58.85 -49.89 76.04 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.285 1.034 . . . . 0.0 111.075 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.0 m . . . . . 0 CA--C 1.529 0.173 0 C-N-CA 124.572 1.149 . . . . 0.0 111.703 -176.541 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -46.12 -45.79 16.69 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.341 1.457 . . . . 0.0 111.473 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.42 -49.22 75.15 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.84 0.856 . . . . 0.0 111.622 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.94 -42.4 90.09 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.151 0.98 . . . . 0.0 109.604 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -60.85 -44.93 96.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.352 1.061 . . . . 0.0 110.983 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -60.39 -50.42 73.66 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.253 0.621 . . . . 0.0 110.344 176.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -54.84 -51.49 65.73 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.932 0.893 . . . . 0.0 110.805 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -56.0 -54.48 44.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.757 0.823 . . . . 0.0 110.41 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.06 -40.68 73.93 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.391 1.076 . . . . 0.0 111.831 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -52.18 66.78 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -89.8 51.47 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.956 0.902 . . . . 0.0 110.358 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -119.38 81.32 22.51 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.283 1.033 . . . . 0.0 109.458 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.2 -20.3 24.91 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.203 2.602 . . . . 0.0 111.886 177.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -60.86 -37.01 80.63 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.851 0.861 . . . . 0.0 110.866 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -89.28 159.3 17.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.493 0.717 . . . . 0.0 109.413 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 -89.54 175.08 7.43 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.763 0.825 . . . . 0.0 108.81 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.38 -33.2 72.12 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.86 -63.2 1.38 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.806 0.843 . . . . 0.0 110.898 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.42 -35.47 81.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.805 0.442 . . . . 0.0 110.885 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.2 ttp-105 -61.2 -52.55 64.32 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.071 0.549 . . . . 0.0 111.108 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -63.88 -38.35 90.77 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.731 0.696 . . . . 0.0 110.946 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -42.96 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.752 0.421 . . . . 0.0 110.821 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -61.07 -48.85 79.82 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.71 0.804 . . . . 0.0 110.387 177.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.1 -49.64 60.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 123.426 0.691 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -58.18 -42.67 86.59 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.739 0.816 . . . . 0.0 111.253 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -59.68 -48.63 80.91 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 122.865 0.466 . . . . 0.0 111.263 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.15 -46.93 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 118.268 0.485 . . . . 0.0 109.971 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -61.31 -33.81 74.21 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.593 0.757 . . . . 0.0 111.815 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -70.83 -44.94 65.44 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.172 0.589 . . . . 0.0 110.143 175.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -58.47 -52.6 64.95 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.423 1.089 . . . . 0.0 110.716 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 122.818 0.447 . . . . 0.0 110.834 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 13.1 pt20 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.5 m -68.93 -37.67 79.05 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 171.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -58.84 -42.63 89.74 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.835 0.454 . . . . 0.0 110.676 171.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 90.7 mtt-85 -63.25 -42.57 99.2 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.978 0.511 . . . . 0.0 110.416 177.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 9' ' ' GLN . 28.5 mmm180 -56.97 -51.12 70.49 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.052 0.541 . . . . 0.0 110.884 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -57.0 -52.62 64.56 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 122.571 0.348 . . . . 0.0 110.843 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -51.3 -59.73 3.9 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.349 1.06 . . . . 0.0 110.81 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -54.75 -48.42 72.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.759 0.824 . . . . 0.0 111.243 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.09 -45.95 86.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.748 0.819 . . . . 0.0 112.212 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.5 mt -59.77 -39.91 86.47 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.081 0.952 . . . . 0.0 111.942 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -89.2 -36.84 15.42 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.882 0.473 . . . . 0.0 111.543 -172.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.36 134.18 95.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.6 -126.48 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.945 2.43 . . . . 0.0 107.581 174.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 55.85 17.72 2.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.746 1.218 . . . . 0.0 113.289 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.3 mt -150.03 134.03 17.0 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.43 1.492 . . . . 0.0 107.64 -170.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.1 p30 -89.79 -176.36 4.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 169.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.79 -52.47 65.33 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.039 0.536 . . . . 0.0 111.195 -177.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -61.27 -53.33 58.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.289 0.636 . . . . 0.0 110.971 -174.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -62.39 -42.55 99.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.5 ttp85 -56.32 -61.46 2.39 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.013 0.525 . . . . 0.0 110.171 176.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -60.14 -35.87 76.24 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.251 -0.404 . . . . 0.0 111.986 -176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.69 -43.12 99.63 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.048 0.539 . . . . 0.0 111.295 175.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -69.64 -45.26 68.87 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 110.162 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.7 mm -54.47 -48.12 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.045 0.938 . . . . 0.0 110.017 172.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -58.14 -45.41 87.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.836 0.854 . . . . 0.0 110.911 177.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -57.68 -48.4 79.65 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.939 0.496 . . . . 0.0 111.057 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -57.96 -52.63 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.136 0.574 . . . . 0.0 109.64 176.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -57.28 -43.36 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.152 0.981 . . . . 0.0 112.065 -177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.04 -47.86 73.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.391 0.677 . . . . 0.0 110.319 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -51.97 67.61 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.024 0.93 . . . . 0.0 111.374 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 CA--C 1.529 0.168 0 C-N-CA 124.805 1.242 . . . . 0.0 111.282 -177.632 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 m -61.72 -35.3 77.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.585 0.629 . . . . 0.0 111.862 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -59.89 -55.27 36.23 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.388 0.54 . . . . 0.0 111.678 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.67 -30.62 71.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.427 0.558 . . . . 0.0 111.882 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -65.69 -43.11 90.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.205 0.602 . . . . 0.0 110.798 174.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -59.63 -50.86 72.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.916 0.78 . . . . 0.0 110.348 174.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -54.75 -49.8 69.96 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.291 1.037 . . . . 0.0 110.637 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -55.81 -54.03 49.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.895 0.878 . . . . 0.0 110.354 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.88 -47.0 71.51 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.19 0.996 . . . . 0.0 112.166 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.6 mt -53.59 -39.4 64.83 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.983 0.913 . . . . 0.0 112.182 177.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -98.92 -20.07 17.0 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.79 0.836 . . . . 0.0 113.166 -169.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.76 122.95 79.77 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.414 0.686 . . . . 0.0 110.493 -173.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.49 -29.31 11.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.479 2.786 . . . . 0.0 112.668 -173.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -63.53 -28.3 69.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.464 0.705 . . . . 0.0 111.203 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.4 mt -89.63 128.48 36.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -88.8 -165.97 1.48 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.16 -51.32 70.21 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.918 0.487 . . . . 0.0 111.001 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -58.24 -57.29 13.51 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.15 0.98 . . . . 0.0 110.598 -177.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -56.48 -41.98 77.49 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.148 1.379 . . . . 0.0 110.881 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.87 -55.22 28.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.346 0.658 . . . . 0.0 109.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -58.07 -41.21 82.9 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.819 0.736 . . . . 0.0 111.326 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.85 -44.4 94.14 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.802 0.441 . . . . 0.0 111.204 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.44 -50.43 72.83 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.14 0.976 . . . . 0.0 110.472 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.1 mm -52.69 -49.36 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.867 0.867 . . . . 0.0 110.084 175.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.5 -47.52 76.09 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.049 0.94 . . . . 0.0 110.94 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.5 m -60.76 -41.22 95.02 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.414 0.686 . . . . 0.0 112.027 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.5 mt -67.66 -49.62 68.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.496 -177.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -65.62 -36.48 83.85 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 118.202 0.455 . . . . 0.0 111.7 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.19 -46.22 90.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.086 0.555 . . . . 0.0 110.602 172.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -58.16 -57.22 13.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.455 1.102 . . . . 0.0 111.595 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.531 0.224 0 CA-C-N 117.914 0.325 . . . . 0.0 111.807 179.266 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.7 m -59.47 -43.86 93.16 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 124.082 0.953 . . . . 0.0 109.717 169.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -60.12 -43.79 95.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.125 0.57 . . . . 0.0 110.75 173.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -64.22 -37.6 88.07 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.187 0.595 . . . . 0.0 111.158 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -65.52 -46.38 79.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.119 0.968 . . . . 0.0 110.403 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.85 -54.79 42.94 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.285 0.493 . . . . 0.0 110.518 173.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -53.4 -48.4 68.72 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.777 1.631 . . . . 0.0 111.09 -177.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.09 -51.62 68.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.361 1.064 . . . . 0.0 110.782 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.98 -44.89 79.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.603 0.761 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -59.82 -52.71 64.28 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.823 0.849 . . . . 0.0 110.339 175.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -89.75 53.73 2.65 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.345 0.658 . . . . 0.0 110.501 -174.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -160.26 136.78 6.45 Favored Pre-proline 0 N--CA 1.453 -0.281 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -80.17 -129.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.845 2.363 . . . . 0.0 107.453 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 56.34 13.42 1.27 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.884 1.273 . . . . 0.0 113.429 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.5 mt -150.03 132.01 15.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.53 1.532 . . . . 0.0 107.392 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -89.8 -172.72 3.64 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -51.63 -52.56 46.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.374 0.669 . . . . 0.0 110.775 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -59.14 -56.83 17.1 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.701 0.8 . . . . 0.0 110.91 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -60.89 -40.46 93.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.898 0.879 . . . . 0.0 111.376 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.28 -57.3 13.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.569 0.748 . . . . 0.0 110.259 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -62.36 -35.7 79.95 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.256 -178.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.97 -43.76 98.16 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.049 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.22 -50.69 72.07 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.596 0.758 . . . . 0.0 110.299 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.17 -47.84 76.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 122.831 0.452 . . . . 0.0 110.106 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.9 tttp -58.42 -44.34 89.03 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.346 0.658 . . . . 0.0 111.247 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.4 m -61.68 -48.31 81.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.586 0.754 . . . . 0.0 111.084 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 49.8 mt -60.64 -47.63 92.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 123.587 0.755 . . . . 0.0 109.834 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 51.4 ttm-85 -64.21 -39.83 94.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.218 1.007 . . . . 0.0 111.674 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -65.0 -50.44 66.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.776 0.83 . . . . 0.0 110.355 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.76 -52.95 62.18 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.796 1.238 . . . . 0.0 111.216 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.455 -0.177 0 C-N-CA 124.123 0.969 . . . . 0.0 111.733 -177.669 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 119.623 -0.227 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.53 -45.56 86.66 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.93 0.492 . . . . 0.0 110.58 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -54.87 -54.46 42.18 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.689 0.796 . . . . 0.0 110.643 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.0 -42.71 80.79 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.88 1.272 . . . . 0.0 110.834 177.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.3 -51.32 70.43 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.135 0.974 . . . . 0.0 111.708 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -58.63 -52.47 65.55 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 118.068 0.395 . . . . 0.0 110.407 177.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -54.66 -51.3 65.9 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.186 0.994 . . . . 0.0 111.42 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.98 -53.38 59.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.618 1.167 . . . . 0.0 110.764 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -39.19 90.97 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.88 0.872 . . . . 0.0 112.117 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 mt -57.83 -52.0 67.29 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.042 0.537 . . . . 0.0 109.721 173.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.32 0.648 . . . . 0.0 110.139 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -126.03 92.86 45.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.689 1.195 . . . . 0.0 108.509 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -72.81 -28.21 13.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.051 2.5 . . . . 0.0 111.92 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -60.59 -33.01 72.09 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.974 0.91 . . . . 0.0 111.2 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.13 137.18 32.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -88.77 172.72 9.02 Favored 'General case' 0 C--N 1.338 0.085 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -50.92 -41.16 58.53 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.323 0.649 . . . . 0.0 112.524 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.36 -62.38 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.188 0.595 . . . . 0.0 110.93 -176.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -64.65 -37.57 88.01 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.233 0.613 . . . . 0.0 111.012 -176.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -59.83 -54.67 43.55 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.959 0.904 . . . . 0.0 110.619 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.99 -40.53 95.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.163 0.438 . . . . 0.0 110.94 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.06 91.02 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.048 0.539 . . . . 0.0 110.916 175.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -50.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.809 0.444 . . . . 0.0 110.237 178.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.2 mm -53.24 -46.25 56.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.177 0.991 . . . . 0.0 110.127 178.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.69 -46.99 87.4 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.586 0.754 . . . . 0.0 111.016 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.2 t -61.92 -47.96 82.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.437 0.695 . . . . 0.0 111.282 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.75 -45.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 124.329 1.052 . . . . 0.0 109.125 177.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -64.08 -40.86 97.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.896 0.878 . . . . 0.0 111.598 -178.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.96 -48.6 81.04 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.264 0.626 . . . . 0.0 110.417 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.07 -51.62 67.2 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.786 0.834 . . . . 0.0 111.514 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 93.7 m . . . . . 0 CA--C 1.531 0.212 0 C-N-CA 125.185 1.394 . . . . 0.0 112.157 -175.331 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -57.73 -43.48 85.33 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.02 0.928 . . . . 0.0 111.29 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -56.92 -50.97 70.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.718 0.807 . . . . 0.0 110.674 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -63.35 -38.64 91.94 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.749 0.82 . . . . 0.0 111.659 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.7 mtp180 -62.03 -48.27 81.01 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.902 0.881 . . . . 0.0 110.458 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.88 -49.94 75.02 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.111 0.564 . . . . 0.0 111.031 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -57.64 -49.44 76.46 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.128 0.971 . . . . 0.0 110.883 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -55.92 -56.36 21.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.949 0.9 . . . . 0.0 110.15 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -40.65 76.86 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.186 0.994 . . . . 0.0 111.873 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 tp -60.09 -49.48 77.46 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.658 0.783 . . . . 0.0 109.812 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -93.39 58.44 2.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.75 0.82 . . . . 0.0 109.928 -178.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -129.11 86.89 55.78 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.803 0.841 . . . . 0.0 110.564 -178.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.57 -26.36 78.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 124.036 3.157 . . . . 0.0 113.318 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -55.39 -45.12 76.64 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.963 1.305 . . . . 0.0 111.855 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.0 mt -89.28 163.64 15.28 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.575 0.75 . . . . 0.0 109.644 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -89.41 -175.53 4.76 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.573 0.749 . . . . 0.0 109.37 174.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.3 -54.87 30.3 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 111.029 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -56.28 -52.86 62.95 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.567 0.747 . . . . 0.0 110.634 -179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.7 mm100 -60.65 -41.32 94.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 111.981 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ttp-105 -64.44 -46.97 80.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.084 0.554 . . . . 0.0 110.873 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -61.52 -39.08 89.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.106 0.412 . . . . 0.0 110.88 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.87 -44.05 97.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.957 0.503 . . . . 0.0 110.859 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -58.93 -50.59 73.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 0.0 110.507 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.0 mm -53.73 -47.75 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.704 0.802 . . . . 0.0 110.17 175.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.08 -45.2 93.69 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.568 0.747 . . . . 0.0 111.328 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -60.75 -45.57 93.78 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.645 0.778 . . . . 0.0 111.197 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.63 -47.33 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 123.426 0.691 . . . . 0.0 109.638 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -62.26 -43.29 99.16 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.613 0.765 . . . . 0.0 111.853 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.8 -50.82 70.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.842 0.857 . . . . 0.0 110.571 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.82 -53.51 57.41 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.643 1.177 . . . . 0.0 111.282 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.6 m . . . . . 0 CA--C 1.531 0.233 0 C-N-CA 124.33 1.052 . . . . 0.0 112.293 -175.27 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 . . . . . 0 CA--C 1.53 0.21 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.84 -36.36 78.08 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.666 0.787 . . . . 0.0 111.732 -178.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.9 tm0? -56.0 -53.02 61.93 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.415 0.686 . . . . 0.0 109.995 170.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -59.16 -41.76 89.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.165 0.986 . . . . 0.0 111.395 179.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -61.48 -49.39 76.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.364 0.666 . . . . 0.0 111.009 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -56.23 -56.08 25.42 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.232 0.469 . . . . 0.0 110.391 176.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -53.33 -52.77 58.1 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.209 1.404 . . . . 0.0 110.917 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -54.73 -55.76 26.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.165 0.986 . . . . 0.0 110.292 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.81 -44.28 70.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.708 0.803 . . . . 0.0 111.853 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.56 -46.85 63.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.069 1.348 . . . . 0.0 110.679 178.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -89.73 -30.8 17.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.669 0.788 . . . . 0.0 112.782 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -57.01 110.79 2.66 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 111.926 -169.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.15 -22.44 22.47 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.055 2.503 . . . . 0.0 112.126 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -61.3 -27.61 68.6 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.19 0.596 . . . . 0.0 111.011 175.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -89.61 132.36 35.15 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 172.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.4 p30 -89.18 -174.18 4.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 171.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.56 -44.02 68.93 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.54 0.736 . . . . 0.0 112.672 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.57 -59.83 3.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.365 1.066 . . . . 0.0 109.954 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -52.87 -46.68 68.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.927 1.291 . . . . 0.0 110.63 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 ttp-105 -61.97 -57.13 12.88 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.329 1.052 . . . . 0.0 111.327 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -61.22 -41.38 96.76 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.277 0.944 . . . . 0.0 111.077 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.71 -46.56 81.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.419 0.688 . . . . 0.0 111.016 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.69 -48.48 81.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.094 0.958 . . . . 0.0 110.91 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.7 mm -55.06 -49.43 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 122.901 0.481 . . . . 0.0 110.0 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -59.85 -40.95 90.31 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.929 0.492 . . . . 0.0 111.87 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -60.74 -46.91 88.63 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.92 0.488 . . . . 0.0 110.821 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 33.1 mt -64.94 -41.19 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.642 0.777 . . . . 0.0 109.766 178.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -57.12 -48.3 79.0 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.15 0.98 . . . . 0.0 110.565 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -63.76 -57.45 9.92 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.528 0.731 . . . . 0.0 110.635 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -50.25 -56.06 12.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.482 1.513 . . . . 0.0 111.977 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.664 1.185 . . . . 0.0 113.069 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.8 m -58.21 -45.02 88.39 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.032 0.533 . . . . 0.0 110.411 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -58.53 -48.49 80.67 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.665 0.786 . . . . 0.0 111.412 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -55.81 -48.51 75.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.263 1.025 . . . . 0.0 110.57 175.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.2 mtp180 -60.35 -47.15 87.3 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.178 0.591 . . . . 0.0 111.244 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -57.52 -51.14 70.67 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.495 0.718 . . . . 0.0 110.552 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -54.78 -58.96 5.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.386 1.074 . . . . 0.0 110.619 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -53.99 -51.11 64.98 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.53 0.732 . . . . 0.0 111.048 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.76 -49.1 76.27 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.618 0.767 . . . . 0.0 111.509 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.9 -43.14 65.96 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.67 1.188 . . . . 0.0 111.743 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -89.71 -22.64 22.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.441 0.696 . . . . 0.0 112.602 -174.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.95 114.64 6.74 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.241 1.016 . . . . 0.0 111.097 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -76.81 -28.42 6.33 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.094 2.529 . . . . 0.0 111.934 -177.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -56.09 -42.26 76.47 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 124.821 1.249 . . . . 0.0 112.126 -173.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.3 mt -89.26 139.4 30.53 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -88.77 -177.69 5.59 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.023 0.929 . . . . 0.0 108.916 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -46.99 -51.95 15.91 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.793 0.837 . . . . 0.0 112.056 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -63.14 -56.47 16.5 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.564 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -66.86 -43.29 83.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.287 0.635 . . . . 0.0 110.942 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -60.92 -49.46 77.37 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.832 0.853 . . . . 0.0 110.298 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -63.42 -41.67 98.7 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.804 0.842 . . . . 0.0 110.258 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.85 -38.3 75.42 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.569 0.347 . . . . 0.0 111.178 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -62.36 -46.98 86.23 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 110.065 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.7 mm -55.55 -48.23 77.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.084 0.554 . . . . 0.0 110.151 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -57.37 -42.07 81.38 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.75 0.42 . . . . 0.0 111.383 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 m -62.19 -44.08 97.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.235 0.614 . . . . 0.0 111.465 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.66 -45.82 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -60.99 -38.17 85.03 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.671 0.788 . . . . 0.0 111.645 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -66.01 -47.63 73.84 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.453 0.701 . . . . 0.0 110.381 174.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -58.08 -54.6 45.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.4 1.08 . . . . 0.0 111.307 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.207 0 C-N-CA 123.149 0.58 . . . . 0.0 111.553 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 110.591 -0.152 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.7 -51.74 67.61 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.77 0.428 . . . . 0.0 111.442 174.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -50.84 -55.9 14.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.597 1.159 . . . . 0.0 110.82 -178.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -55.82 -53.9 51.08 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.57 0.748 . . . . 0.0 111.091 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -59.9 -45.5 92.36 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.888 -176.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.1 -56.85 16.41 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.135 0.574 . . . . 0.0 110.281 176.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -49.63 -56.75 8.93 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -55.51 -51.11 68.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.998 0.919 . . . . 0.0 110.919 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.48 87.69 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.619 0.768 . . . . 0.0 112.227 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.5 mt -58.33 -44.67 88.78 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.009 0.924 . . . . 0.0 111.837 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -89.35 -43.61 10.79 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.874 0.47 . . . . 0.0 111.749 -170.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.84 136.27 90.15 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 109.744 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.54 -127.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.864 2.376 . . . . 0.0 107.717 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 54.72 15.62 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.787 1.235 . . . . 0.0 113.49 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.5 mt -150.0 133.18 16.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.431 1.493 . . . . 0.0 107.635 -170.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -89.41 170.79 10.23 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 170.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -48.43 -57.41 6.12 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.282 1.033 . . . . 0.0 112.302 -173.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -57.45 -48.61 78.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.576 0.75 . . . . 0.0 111.35 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -68.54 -35.08 76.94 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.678 0.791 . . . . 0.0 111.533 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -67.33 -48.27 68.04 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.162 0.437 . . . . 0.0 109.859 177.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -59.42 -39.87 84.9 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.615 0.366 . . . . 0.0 111.019 174.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.05 -39.97 94.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.972 0.509 . . . . 0.0 111.303 176.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.5 -50.74 71.49 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.449 0.7 . . . . 0.0 110.196 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.8 mm -55.01 -48.64 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 122.99 0.516 . . . . 0.0 110.388 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -58.71 -45.45 89.51 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.014 0.526 . . . . 0.0 111.197 178.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.5 t -59.24 -46.74 87.68 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.629 0.771 . . . . 0.0 111.023 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -49.3 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 123.983 0.913 . . . . 0.0 109.945 177.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -57.19 -39.45 75.41 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.876 1.271 . . . . 0.0 111.953 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.67 -45.82 67.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.118 0.567 . . . . 0.0 110.344 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.89 -51.46 67.5 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.56 1.144 . . . . 0.0 111.054 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.5 m . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 123.338 0.655 . . . . 0.0 110.39 178.069 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.426 0.155 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 m -64.74 -49.11 72.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.349 0.66 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -61.13 -44.55 97.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.914 0.486 . . . . 0.0 111.217 179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -55.17 -51.01 67.85 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.806 1.242 . . . . 0.0 110.56 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -66.46 -38.97 88.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.718 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -58.19 -56.61 19.88 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.848 0.749 . . . . 0.0 110.01 174.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -51.81 -50.74 60.23 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.34 1.456 . . . . 0.0 110.743 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -55.96 -55.17 35.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.739 0.816 . . . . 0.0 110.665 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.23 -39.62 75.91 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.988 0.915 . . . . 0.0 112.121 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.43 -47.71 78.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.79 1.236 . . . . 0.0 110.489 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -89.36 -30.59 18.29 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.484 0.714 . . . . 0.0 111.912 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.11 123.9 67.29 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 124.648 1.179 . . . . 0.0 109.684 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -79.96 -135.98 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.961 2.441 . . . . 0.0 106.151 170.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.6 m120 70.18 -52.24 0.64 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.183 1.793 . . . . 0.0 112.407 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -88.88 151.7 22.18 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 126.269 1.828 . . . . 0.0 108.552 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -89.47 -174.64 4.43 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 172.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -58.18 -46.46 85.71 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.795 0.838 . . . . 0.0 111.717 -175.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -64.57 -48.86 73.43 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.879 -176.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -67.5 -35.09 78.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.166 0.586 . . . . 0.0 111.51 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -61.06 -51.4 69.32 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 172.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -59.94 -37.06 78.41 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.992 0.517 . . . . 0.0 111.122 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.29 97.84 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.402 0.681 . . . . 0.0 110.948 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -59.57 -52.09 67.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.466 0.707 . . . . 0.0 110.253 176.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.6 mm -52.96 -51.09 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.109 0.564 . . . . 0.0 109.98 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -57.33 -46.07 83.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.535 1.134 . . . . 0.0 111.656 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 p -64.41 -38.14 89.98 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.136 0.426 . . . . 0.0 111.672 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.69 -45.34 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.16 -40.91 82.62 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.557 0.743 . . . . 0.0 111.097 176.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.87 -51.18 63.39 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.515 0.726 . . . . 0.0 110.582 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.69 -50.32 66.12 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.076 1.351 . . . . 0.0 111.272 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.1 m . . . . . 0 N--CA 1.454 -0.248 0 C-N-CA 124.433 1.093 . . . . 0.0 111.777 -176.183 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 58.6 m -59.6 -55.57 32.82 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.372 1.069 . . . . 0.0 110.686 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -67.88 -34.55 76.89 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -61.09 -47.86 84.35 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.929 0.492 . . . . 0.0 109.865 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.34 -41.49 96.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 118.495 -0.765 . . . . 0.0 111.393 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.18 -52.02 64.67 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.083 0.856 . . . . 0.0 110.341 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -55.46 -57.45 11.85 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.613 1.165 . . . . 0.0 110.696 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -54.18 -51.55 64.0 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.175 0.59 . . . . 0.0 111.102 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.55 -46.87 85.94 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.692 0.797 . . . . 0.0 111.649 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.27 -43.49 67.49 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.747 1.219 . . . . 0.0 111.47 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -89.54 -19.24 25.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.18 0.592 . . . . 0.0 112.31 -175.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.33 120.01 44.32 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 123.535 0.734 . . . . 0.0 110.783 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -81.17 -28.96 2.17 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.444 2.763 . . . . 0.0 111.955 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -55.89 -40.98 73.77 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.697 -174.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.0 mt -89.17 130.55 35.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 172.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -89.0 -178.82 5.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 178.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -41.4 -63.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.193 1.397 . . . . 0.0 113.528 -171.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.11 -44.65 91.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -64.85 -44.87 88.38 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.785 0.834 . . . . 0.0 110.645 -178.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -63.21 -47.61 81.8 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.483 1.513 . . . . 0.0 110.378 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -59.65 -42.34 92.55 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.382 0.673 . . . . 0.0 110.674 176.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.5 -38.05 85.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.623 0.369 . . . . 0.0 111.084 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -62.1 -49.98 73.77 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.673 0.789 . . . . 0.0 109.988 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 34.4 mm -53.62 -47.43 61.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.833 0.853 . . . . 0.0 110.221 174.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -56.93 -46.27 82.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.874 0.87 . . . . 0.0 110.927 178.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.0 m -60.81 -41.3 95.43 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.626 0.77 . . . . 0.0 111.779 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 46.8 mt -63.23 -52.11 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 118.15 0.432 . . . . 0.0 110.284 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -67.99 -33.79 75.3 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.12 -51.63 68.77 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.361 0.664 . . . . 0.0 110.496 172.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -56.98 -51.28 69.83 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.961 1.304 . . . . 0.0 111.094 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.6 m . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.369 1.067 . . . . 0.0 111.769 -178.349 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 . . . . . 0 CA--C 1.532 0.271 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.2 m -54.9 -54.3 44.39 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.636 0.774 . . . . 0.0 109.165 170.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -53.4 -41.46 65.99 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.371 1.068 . . . . 0.0 111.593 177.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -64.34 -49.1 73.03 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 122.674 0.39 . . . . 0.0 110.762 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -57.88 -47.08 83.79 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.037 177.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -55.7 -57.87 10.19 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.946 0.498 . . . . 0.0 110.91 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -50.37 -58.79 4.9 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.425 1.49 . . . . 0.0 111.19 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.75 -51.28 69.47 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.548 0.739 . . . . 0.0 110.899 -178.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.39 -41.54 72.8 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.401 0.68 . . . . 0.0 112.002 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -57.26 -48.26 79.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.273 1.029 . . . . 0.0 110.46 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -89.09 -23.88 22.41 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -169.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.59 123.24 70.04 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 118.525 0.602 . . . . 0.0 111.002 -172.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.13 -30.89 6.5 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.436 2.757 . . . . 0.0 112.37 -174.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -63.09 -27.51 69.44 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.603 0.761 . . . . 0.0 111.345 -179.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 mp -88.94 125.68 35.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p-10 -88.9 -172.13 3.57 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.16 -42.22 65.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.997 0.519 . . . . 0.0 112.01 178.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.03 -60.85 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.675 0.79 . . . . 0.0 110.886 -176.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -60.32 -39.72 88.01 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.38 0.672 . . . . 0.0 110.536 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 ttp85 -58.69 -61.13 2.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.754 0.822 . . . . 0.0 110.263 177.802 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -61.01 -38.5 86.29 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 119.123 0.874 . . . . 0.0 111.439 -174.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -43.78 92.52 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.677 0.791 . . . . 0.0 111.347 174.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -49.23 69.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.495 0.718 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 31.0 mm -56.02 -40.81 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.95 0.9 . . . . 0.0 109.996 176.471 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -62.32 -48.33 80.32 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.517 0.727 . . . . 0.0 110.852 175.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 m -56.53 -48.74 76.61 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.089 0.556 . . . . 0.0 111.005 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.0 mt -64.67 -39.94 87.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.01 0.524 . . . . 0.0 109.982 -178.842 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -57.16 -41.3 78.92 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.962 0.801 . . . . 0.0 111.538 172.217 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -67.78 -43.77 78.99 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.078 0.399 . . . . 0.0 110.11 -178.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.4 -58.05 7.57 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.557 1.143 . . . . 0.0 111.237 -179.286 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.7 m . . . . . 0 CA--C 1.53 0.175 0 C-N-CA 124.729 1.212 . . . . 0.0 111.599 -173.29 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 . . . . . 0 CA--C 1.53 0.207 0 N-CA-C 110.653 -0.128 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.39 -42.44 96.13 Favored 'General case' 0 C--N 1.338 0.08 0 C-N-CA 123.438 0.695 . . . . 0.0 110.666 177.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -57.78 -48.54 79.38 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.685 0.794 . . . . 0.0 110.569 175.778 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -58.41 -46.41 86.49 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.023 0.929 . . . . 0.0 111.251 176.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 -59.77 -47.76 84.38 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.46 0.704 . . . . 0.0 111.119 179.357 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -58.03 -56.51 21.13 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 122.916 0.486 . . . . 0.0 110.468 176.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -50.44 -51.58 45.41 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.58 1.152 . . . . 0.0 110.9 -179.312 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -56.39 -57.95 10.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.782 0.833 . . . . 0.0 110.514 178.013 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.92 -44.65 74.43 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.093 0.957 . . . . 0.0 112.381 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.5 mt -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.066 0.947 . . . . 0.0 111.583 178.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -89.67 -23.15 21.94 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.242 0.617 . . . . 0.0 112.284 -172.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -60.79 126.4 85.3 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 124.194 0.997 . . . . 0.0 109.828 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.16 -129.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.1 2.533 . . . . 0.0 106.428 170.799 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.1 m120 70.42 -55.76 0.61 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.45 1.9 . . . . 0.0 113.472 175.361 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.3 mt -88.85 166.42 14.0 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.104 1.762 . . . . 0.0 109.193 -177.016 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -89.6 -177.8 5.39 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.039 0.536 . . . . 0.0 109.566 171.448 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -60.56 -55.32 34.82 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.072 0.949 . . . . 0.0 110.853 -175.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -58.8 -49.05 79.14 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.942 0.897 . . . . 0.0 111.34 -176.65 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.88 -46.12 90.33 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.984 0.514 . . . . 0.0 111.232 178.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.8 ttp-105 -64.31 -50.69 66.83 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.955 0.502 . . . . 0.0 111.645 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -63.93 -39.05 93.26 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 118.708 0.685 . . . . 0.0 111.57 179.325 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.62 -38.16 69.13 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.976 0.51 . . . . 0.0 110.987 171.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.12 -45.62 92.68 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.468 0.707 . . . . 0.0 110.366 174.904 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.6 mm -56.64 -48.53 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 122.966 0.506 . . . . 0.0 110.221 175.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -56.62 -46.18 81.08 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.001 0.52 . . . . 0.0 110.876 176.616 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -58.06 -47.62 82.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.57 0.748 . . . . 0.0 111.623 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -58.54 -49.44 82.34 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 176.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -61.82 -41.23 97.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.672 0.789 . . . . 0.0 111.984 -176.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -63.89 -52.1 61.49 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.079 0.952 . . . . 0.0 110.396 176.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.86 -51.96 65.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.638 1.175 . . . . 0.0 111.443 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 97.8 m . . . . . 0 CA--C 1.53 0.182 0 C-N-CA 124.654 1.181 . . . . 0.0 112.234 -175.365 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 93.1 m -60.57 -38.55 84.93 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.246 1.018 . . . . 0.0 112.37 -170.212 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -51.39 -52.74 43.23 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.612 0.765 . . . . 0.0 110.221 173.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -67.58 -36.44 80.91 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.785 0.834 . . . . 0.0 111.443 -177.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -60.44 -52.85 63.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 175.507 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -57.98 -52.38 65.77 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.224 0.609 . . . . 0.0 110.973 178.516 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -55.24 -51.61 66.03 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.882 1.273 . . . . 0.0 111.074 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -57.35 -51.69 68.36 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.959 0.904 . . . . 0.0 110.642 178.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.52 -39.52 76.73 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.87 0.868 . . . . 0.0 111.89 179.668 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.21 70.55 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 175.618 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.561 0.744 . . . . 0.0 110.139 -176.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -129.84 77.07 77.44 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.366 1.067 . . . . 0.0 109.051 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -70.05 -14.78 35.59 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.441 2.761 . . . . 0.0 112.463 -179.395 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -59.46 -36.26 75.63 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 110.047 173.08 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.34 146.31 24.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.243 1.017 . . . . 0.0 108.279 172.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -88.65 179.93 6.16 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -47.77 -51.32 22.82 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.853 1.261 . . . . 0.0 111.754 -178.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.02 -59.28 5.68 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.361 1.064 . . . . 0.0 111.16 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -55.06 -43.19 73.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.36 1.064 . . . . 0.0 111.29 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.8 ttp180 -64.82 -50.62 65.98 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 111.101 -177.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -63.49 -40.14 96.3 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.977 0.808 . . . . 0.0 111.352 178.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.59 88.55 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.443 0.697 . . . . 0.0 110.942 175.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -63.02 -47.86 81.22 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.894 0.877 . . . . 0.0 110.588 177.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.1 mm -54.47 -47.46 70.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.146 0.578 . . . . 0.0 110.525 175.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -61.51 -43.51 98.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.568 0.747 . . . . 0.0 111.363 178.724 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.6 m -60.31 -49.24 78.37 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.214 0.606 . . . . 0.0 110.684 178.232 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.1 mt -57.04 -44.77 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 123.626 0.771 . . . . 0.0 109.38 175.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -64.0 -34.72 78.64 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.309 0.644 . . . . 0.0 111.953 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -68.41 -47.86 66.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.142 0.577 . . . . 0.0 109.855 176.602 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -59.1 -49.81 76.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.235 1.014 . . . . 0.0 111.146 178.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.455 -0.212 0 C-N-CA 125.279 1.432 . . . . 0.0 111.407 -175.138 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 119.772 -0.156 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 90.8 m -63.48 -44.28 94.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.032 0.533 . . . . 0.0 110.762 176.147 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -58.26 -49.8 75.83 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.879 0.472 . . . . 0.0 110.882 177.004 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -54.19 -51.82 63.16 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.336 1.055 . . . . 0.0 110.506 175.265 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -52.79 -48.89 66.54 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.914 1.285 . . . . 0.0 111.391 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -60.9 -53.21 60.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.519 0.328 . . . . 0.0 111.178 176.588 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -54.13 -58.84 5.83 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.994 0.918 . . . . 0.0 111.077 -176.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.41 -45.16 94.6 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.567 -176.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.99 92.05 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.266 0.484 . . . . 0.0 111.455 179.133 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.25 -46.18 79.73 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.743 1.217 . . . . 0.0 111.473 -178.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -89.2 -28.56 19.89 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.059 0.544 . . . . 0.0 111.808 -171.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.88 122.07 59.45 Favored Pre-proline 0 CA--C 1.532 0.277 0 C-N-CA 123.674 0.79 . . . . 0.0 110.175 177.095 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -80.94 -132.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.106 2.537 . . . . 0.0 106.106 169.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 70.55 -50.95 0.67 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.431 1.892 . . . . 0.0 113.073 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.1 mt -88.77 162.04 16.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.883 1.673 . . . . 0.0 108.554 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -90.07 178.64 6.14 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.928 0.394 . . . . 0.0 110.579 175.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.05 -41.09 82.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.925 0.89 . . . . 0.0 111.394 179.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.16 -58.06 10.32 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.35 0.66 . . . . 0.0 110.573 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -55.56 -49.94 71.36 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.828 1.251 . . . . 0.0 110.897 179.132 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 ttp-105 -67.42 -42.41 83.24 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.439 0.695 . . . . 0.0 112.137 -173.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -70.88 -39.18 72.98 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.937 0.789 . . . . 0.0 110.543 178.48 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.2 -40.26 89.47 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.631 0.773 . . . . 0.0 111.298 175.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -58.97 -51.98 67.73 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.67 0.788 . . . . 0.0 109.758 174.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mt -57.5 -40.74 76.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 118.202 0.455 . . . . 0.0 111.52 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -61.02 -42.98 99.5 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 176.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.6 m -64.02 -44.36 92.81 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.632 0.773 . . . . 0.0 111.014 178.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.6 mt -62.15 -49.23 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.2 mtp-105 -52.66 -50.1 63.9 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.97 0.908 . . . . 0.0 111.327 175.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -58.97 -50.51 73.79 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.525 0.73 . . . . 0.0 111.023 -178.703 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.64 -52.21 65.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.37 1.068 . . . . 0.0 111.508 -179.19 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 88.1 m . . . . . 0 N--CA 1.455 -0.191 0 C-N-CA 125.238 1.415 . . . . 0.0 112.264 -173.786 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 111.336 0.124 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -159.85 -165.39 1.5 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.793 1.237 . . . . 0.0 109.464 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.7 mtt -52.18 -43.8 64.35 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.857 1.263 . . . . 0.0 112.305 -178.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -62.2 -42.79 99.61 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 117.993 0.361 . . . . 0.0 110.686 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.9 m -66.24 -45.0 82.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.077 0.951 . . . . 0.0 110.041 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -54.85 -53.83 50.22 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.08 0.952 . . . . 0.0 110.52 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -60.62 -43.55 97.35 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.689 0.796 . . . . 0.0 111.389 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.4 mtp85 -60.6 -45.48 93.84 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.466 0.706 . . . . 0.0 111.206 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -59.19 -52.58 65.07 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.278 0.49 . . . . 0.0 110.296 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -53.85 -48.74 69.68 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.17 0.988 . . . . 0.0 111.096 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -59.15 -53.28 60.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.645 0.778 . . . . 0.0 110.786 176.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.25 77.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.252 1.021 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.42 -53.84 52.69 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.411 0.685 . . . . 0.0 109.708 173.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -89.99 59.72 4.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.612 0.765 . . . . 0.0 110.136 -174.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -133.21 81.33 56.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.698 0.799 . . . . 0.0 110.226 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -54.78 -29.03 60.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 124.541 3.494 . . . . 0.0 114.125 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -58.72 -32.74 69.47 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.86 0.864 . . . . 0.0 111.594 -178.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.6 mt -89.47 153.34 20.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.65 0.78 . . . . 0.0 109.393 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -89.53 -177.65 5.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.35 -51.43 69.44 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.541 0.736 . . . . 0.0 111.431 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -61.04 -51.95 67.02 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.899 0.88 . . . . 0.0 110.383 -174.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.87 -50.85 69.5 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.692 1.197 . . . . 0.0 110.883 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -59.24 -51.4 70.13 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.896 0.878 . . . . 0.0 111.06 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -59.13 -40.09 84.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.093 0.557 . . . . 0.0 111.362 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.654 0.382 . . . . 0.0 111.086 174.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -62.89 -50.7 69.86 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 109.96 178.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.2 mm -53.92 -48.81 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.277 1.031 . . . . 0.0 109.978 175.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -58.0 -43.41 86.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.871 0.869 . . . . 0.0 111.093 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -61.89 -47.18 86.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.36 0.664 . . . . 0.0 111.286 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.2 mt -57.41 -50.76 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -62.1 -43.24 99.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.875 0.87 . . . . 0.0 111.723 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.14 -51.45 69.01 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.919 0.888 . . . . 0.0 110.604 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.99 -52.78 64.31 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.316 1.046 . . . . 0.0 111.392 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.2 m -73.33 -28.85 62.29 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.6 1.16 . . . . 0.0 112.347 -175.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.039 0 CA-C-N 118.131 0.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -74.68 171.61 13.6 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.604 0.761 . . . . 0.0 111.201 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.9 ptp -78.46 54.01 1.38 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.58 1.152 . . . . 0.0 111.358 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 tm0? -155.35 -57.65 0.1 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 125.925 1.69 . . . . 0.0 106.795 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.8 m -59.54 -44.64 93.16 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.803 0.841 . . . . 0.0 109.57 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -49.92 -51.85 37.75 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.521 1.128 . . . . 0.0 111.265 173.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -65.03 -40.25 94.57 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.48 0.712 . . . . 0.0 110.893 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -61.4 -48.29 81.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.252 0.621 . . . . 0.0 110.881 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -57.13 -50.14 73.72 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.229 0.612 . . . . 0.0 110.744 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -57.12 -52.36 65.6 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.08 0.952 . . . . 0.0 110.882 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -55.68 -54.03 49.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.683 0.793 . . . . 0.0 110.751 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.6 -47.63 76.2 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.053 0.941 . . . . 0.0 111.354 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 tp -55.39 -39.25 69.92 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.538 1.135 . . . . 0.0 111.382 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -103.01 20.9 16.7 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.606 0.762 . . . . 0.0 111.987 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -80.16 119.64 77.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 118.697 0.681 . . . . 0.0 110.132 -176.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.18 -28.69 2.3 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.346 2.697 . . . . 0.0 112.128 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -60.87 -41.07 95.25 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.67 1.188 . . . . 0.0 112.076 -172.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.22 162.41 15.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.018 0.927 . . . . 0.0 110.086 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -89.85 -179.47 5.74 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.714 0.806 . . . . 0.0 108.983 169.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.94 -50.15 67.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -60.61 -55.48 32.79 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.045 0.538 . . . . 0.0 111.345 -173.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.02 -36.82 84.3 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.82 0.448 . . . . 0.0 111.36 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.2 ttp-105 -60.88 -49.26 78.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.932 0.493 . . . . 0.0 110.762 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -60.64 -39.39 88.1 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.176 0.59 . . . . 0.0 110.949 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.65 -38.68 88.63 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 117.962 0.347 . . . . 0.0 111.125 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -64.83 -49.81 69.14 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.794 0.838 . . . . 0.0 109.971 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.0 mm -52.84 -47.31 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.408 1.083 . . . . 0.0 110.178 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -59.44 -46.76 87.83 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.452 0.701 . . . . 0.0 110.833 178.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -59.01 -44.57 91.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 111.402 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.41 -47.91 86.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.2 ttm105 -60.34 -42.55 95.93 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.947 0.499 . . . . 0.0 111.888 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -61.98 -48.98 77.92 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.29 0.636 . . . . 0.0 110.461 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -60.51 -54.29 47.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.387 1.075 . . . . 0.0 111.407 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 96.9 m -71.24 -43.94 66.29 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.562 1.145 . . . . 0.0 111.65 -173.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.081 0 O-C-N 122.013 -0.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -163.84 164.84 23.37 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.403 1.081 . . . . 0.0 109.759 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.1 mtt -74.71 72.21 1.98 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.427 1.491 . . . . 0.0 111.885 -169.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 179.44 -42.89 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 127.881 2.472 . . . . 0.0 107.842 176.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.3 m -61.24 -43.9 98.12 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.21 1.004 . . . . 0.0 109.568 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.64 -44.66 96.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.887 0.875 . . . . 0.0 110.952 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -61.16 -46.93 88.51 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.966 0.906 . . . . 0.0 110.618 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -60.55 -46.05 91.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.689 1.196 . . . . 0.0 110.871 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -58.5 -52.95 63.49 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.738 0.415 . . . . 0.0 110.462 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -56.33 -48.25 77.12 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.08 0.952 . . . . 0.0 111.138 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.98 -59.02 5.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.099 0.96 . . . . 0.0 110.346 177.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -47.18 73.34 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.208 1.003 . . . . 0.0 111.716 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 43.4 tp -55.52 -29.28 58.59 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.381 1.472 . . . . 0.0 112.466 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -116.3 16.38 15.79 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.87 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -77.39 119.54 77.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-O 118.669 -0.682 . . . . 0.0 109.647 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.63 -37.18 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.986 2.457 . . . . 0.0 111.814 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -63.71 -38.76 92.31 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.304 1.042 . . . . 0.0 111.399 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -89.15 137.22 32.52 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -89.08 -173.34 4.02 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.55 0.74 . . . . 0.0 109.313 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.59 -42.83 79.37 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.864 0.465 . . . . 0.0 112.115 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.02 -57.01 12.13 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.683 0.793 . . . . 0.0 110.309 -177.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.75 -44.24 93.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.048 0.939 . . . . 0.0 110.924 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -55.36 -56.13 23.66 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.309 1.043 . . . . 0.0 110.109 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.67 -43.05 75.96 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.381 0.673 . . . . 0.0 111.255 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.51 -38.15 80.17 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.94 0.496 . . . . 0.0 111.416 174.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -66.13 -50.37 64.21 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.929 0.892 . . . . 0.0 110.534 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.0 mm -57.74 -41.12 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.093 0.557 . . . . 0.0 109.932 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -61.54 -46.19 90.97 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.261 0.624 . . . . 0.0 111.481 176.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.7 p -63.13 -42.03 99.42 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.172 0.442 . . . . 0.0 111.358 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 54.5 mt -63.79 -53.0 50.01 Favored 'Isoleucine or valine' 0 C--N 1.342 0.253 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -61.97 -38.79 89.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.277 0.49 . . . . 0.0 111.153 -175.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.77 -53.46 53.99 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.855 0.862 . . . . 0.0 110.805 175.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.6 -55.98 27.14 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.912 1.285 . . . . 0.0 111.408 -178.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.9 m -73.4 -36.81 66.08 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 111.763 -175.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.082 0 O-C-N 122.101 -0.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.2 p30 -72.98 173.92 8.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.581 0.752 . . . . 0.0 112.514 -175.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 mmt -60.93 -34.71 75.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.369 1.068 . . . . 0.0 112.652 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -44.84 84.1 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.615 0.766 . . . . 0.0 109.745 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -60.19 -52.13 66.61 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.865 0.866 . . . . 0.0 110.328 175.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -51.05 -50.11 59.25 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.507 1.123 . . . . 0.0 111.389 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 51.7 ttm-85 -55.2 -51.65 65.87 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.576 1.151 . . . . 0.0 110.698 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.95 -42.25 97.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.049 0.54 . . . . 0.0 111.733 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -59.75 -51.4 69.93 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.509 0.595 . . . . 0.0 110.14 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -55.76 -48.66 74.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.308 1.043 . . . . 0.0 111.031 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.99 -55.33 34.09 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.568 0.747 . . . . 0.0 110.221 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.84 -48.13 78.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.377 1.071 . . . . 0.0 111.77 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.77 -41.21 61.45 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.763 0.825 . . . . 0.0 110.926 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -103.22 54.7 0.76 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.114 0.966 . . . . 0.0 109.992 -177.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -129.43 81.88 69.01 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 123.833 0.853 . . . . 0.0 110.166 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.17 -37.25 38.54 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 125.04 3.826 . . . . 0.0 114.281 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -56.64 -35.0 67.86 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.194 0.998 . . . . 0.0 111.884 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.5 mt -89.57 138.41 31.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -88.83 -177.04 5.41 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -51.96 -47.68 64.69 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -61.51 -60.4 3.76 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.422 0.689 . . . . 0.0 110.615 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -58.21 -44.8 88.33 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.517 0.727 . . . . 0.0 111.14 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -62.31 -50.7 70.6 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.954 0.902 . . . . 0.0 110.397 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.4 -41.35 84.73 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.878 0.471 . . . . 0.0 110.956 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.05 89.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.809 0.444 . . . . 0.0 111.174 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -62.83 -50.59 70.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.917 0.887 . . . . 0.0 110.016 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 32.7 mm -53.96 -49.56 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 123.848 0.859 . . . . 0.0 109.875 175.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -56.54 -47.23 79.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.518 0.727 . . . . 0.0 110.954 179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -58.11 -47.82 82.09 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.637 0.775 . . . . 0.0 111.446 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 51.6 mt -58.33 -48.41 85.08 Favored 'Isoleucine or valine' 0 C--N 1.341 0.234 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -63.91 -34.54 78.18 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.441 0.696 . . . . 0.0 112.126 -175.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -66.88 -51.39 56.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.461 0.705 . . . . 0.0 109.9 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.05 -47.38 74.88 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.599 1.16 . . . . 0.0 111.391 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.8 m -77.2 -37.45 53.53 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.787 -175.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.049 0 O-C-N 122.031 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 120.011 -0.042 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -72.6 176.5 5.41 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.524 0.73 . . . . 0.0 111.919 -176.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 45.2 tpp -48.98 -51.74 28.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.544 1.537 . . . . 0.0 112.019 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.09 -47.2 87.39 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.75 0.42 . . . . 0.0 110.469 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -61.68 -50.09 73.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.774 0.43 . . . . 0.0 111.292 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -36.07 80.1 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -62.75 -50.86 69.39 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.301 0.64 . . . . 0.0 109.618 176.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -58.57 -43.99 89.57 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.382 0.673 . . . . 0.0 111.242 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -55.38 -54.06 48.39 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 118.697 0.681 . . . . 0.0 110.283 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -54.03 -58.81 5.91 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.125 0.97 . . . . 0.0 111.384 -175.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.69 -40.03 95.84 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.23 99.1 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.216 0.607 . . . . 0.0 111.348 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -51.09 71.09 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -89.34 49.03 1.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.588 0.755 . . . . 0.0 110.494 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -117.88 98.95 52.01 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 124.417 1.087 . . . . 0.0 108.587 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.45 -23.97 14.53 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.09 2.526 . . . . 0.0 112.019 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -61.34 -37.01 81.74 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.899 0.879 . . . . 0.0 110.655 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.28 146.66 24.58 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.179 0.992 . . . . 0.0 108.761 177.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -89.32 -177.29 5.34 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -57.85 -46.07 85.34 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.065 0.946 . . . . 0.0 111.467 -176.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -57.94 -57.79 11.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.349 0.66 . . . . 0.0 110.276 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.47 -47.67 75.74 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.129 0.972 . . . . 0.0 110.929 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm105 -55.1 -57.57 11.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.768 1.227 . . . . 0.0 110.511 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -59.08 -39.37 81.95 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.943 0.497 . . . . 0.0 111.597 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.67 91.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.215 0.461 . . . . 0.0 111.244 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -65.23 -48.59 72.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.021 0.928 . . . . 0.0 109.87 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -55.68 -46.35 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.641 0.777 . . . . 0.0 110.143 175.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -58.13 -43.6 87.33 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.226 0.61 . . . . 0.0 111.021 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -60.4 -48.28 82.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.921 0.488 . . . . 0.0 111.192 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.74 -46.27 96.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 123.334 0.654 . . . . 0.0 110.179 178.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -62.75 -31.56 72.53 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.326 1.05 . . . . 0.0 111.509 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.23 -44.46 62.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.275 0.63 . . . . 0.0 109.925 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.81 -51.86 67.86 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.161 0.984 . . . . 0.0 110.661 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -50.52 64.42 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.793 0.437 . . . . 0.0 110.803 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.135 0 O-C-N 122.443 -0.16 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.7 p-10 -88.06 -178.01 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.615 0.766 . . . . 0.0 109.732 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 92.4 mmm -57.29 -38.81 74.53 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.341 0.656 . . . . 0.0 112.059 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.66 -57.72 10.9 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.706 0.402 . . . . 0.0 110.373 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.4 m -63.0 -44.0 97.23 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.857 0.463 . . . . 0.0 111.169 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.97 -55.97 19.53 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.36 1.064 . . . . 0.0 111.188 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -60.81 -45.35 94.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.872 0.869 . . . . 0.0 110.682 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -65.18 -37.12 86.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.765 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.36 -55.09 39.17 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.022 0.828 . . . . 0.0 109.659 174.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -52.26 -53.7 40.57 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.237 1.015 . . . . 0.0 110.517 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -54.25 -57.18 12.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.596 0.759 . . . . 0.0 110.804 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.1 -45.54 71.86 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.977 0.911 . . . . 0.0 111.912 -177.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.39 -47.13 63.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.828 1.251 . . . . 0.0 110.487 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -89.33 -19.81 24.82 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.599 0.76 . . . . 0.0 112.246 -173.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.74 117.85 24.18 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.421 1.089 . . . . 0.0 111.316 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -82.73 -24.66 3.33 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.557 2.838 . . . . 0.0 112.069 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -58.93 -38.72 79.62 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.474 1.11 . . . . 0.0 111.754 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -89.13 147.94 23.94 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -89.13 -179.74 5.96 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.628 0.771 . . . . 0.0 108.954 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.05 -48.64 61.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.516 0.726 . . . . 0.0 111.774 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -60.36 -58.63 7.7 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.91 0.884 . . . . 0.0 110.719 -175.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -66.32 -33.13 75.03 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.485 0.714 . . . . 0.0 111.834 -177.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -66.51 -48.7 68.94 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.844 0.857 . . . . 0.0 110.564 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.27 -39.49 94.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.153 0.433 . . . . 0.0 110.834 176.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.25 -42.98 96.47 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.72 0.408 . . . . 0.0 111.079 175.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.76 -50.95 71.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.084 0.954 . . . . 0.0 110.264 176.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.7 mm -52.28 -51.05 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.089 0.555 . . . . 0.0 110.003 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.7 -43.77 85.41 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.43 0.692 . . . . 0.0 111.527 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -59.13 -47.49 85.09 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.996 0.519 . . . . 0.0 110.751 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.6 mt -64.12 -42.55 95.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.422 0.689 . . . . 0.0 110.21 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -58.32 -39.31 79.07 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.004 0.521 . . . . 0.0 110.887 174.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.59 -41.39 72.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.552 0.741 . . . . 0.0 110.495 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -54.78 -57.07 13.02 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.455 1.102 . . . . 0.0 111.013 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 57.2 m -76.49 -52.0 10.66 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 117.661 0.209 . . . . 0.0 111.043 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.089 0 O-C-N 122.018 -0.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.348 0.129 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -158.13 -174.83 5.01 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.322 1.049 . . . . 0.0 109.737 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -54.21 -43.44 70.78 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.798 1.239 . . . . 0.0 111.5 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -59.49 -39.67 84.53 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.392 0.677 . . . . 0.0 111.339 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.0 m -62.35 -46.92 86.51 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.69 0.396 . . . . 0.0 109.95 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -60.49 -47.65 85.22 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 122.888 0.475 . . . . 0.0 111.413 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -55.21 -49.6 71.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.679 1.191 . . . . 0.0 110.616 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.21 -40.69 96.58 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.792 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -58.54 -52.74 64.38 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.909 0.777 . . . . 0.0 110.437 176.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -54.93 -52.4 63.07 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.54 1.136 . . . . 0.0 110.687 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.28 -55.82 27.08 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.54 0.736 . . . . 0.0 110.071 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.0 -46.43 71.74 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 111.561 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.02 -50.1 48.59 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.243 1.017 . . . . 0.0 109.966 177.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.01 3.08 54.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.935 0.894 . . . . 0.0 113.031 -175.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -73.21 122.06 86.69 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 119.008 0.822 . . . . 0.0 110.89 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -80.15 -28.47 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.256 2.637 . . . . 0.0 112.037 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -60.55 -47.07 87.82 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.185 0.994 . . . . 0.0 111.769 -171.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.9 mt -89.49 150.27 22.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.72 0.808 . . . . 0.0 109.541 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -89.46 -174.76 4.48 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.01 0.924 . . . . 0.0 109.274 175.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -51.39 -52.7 43.65 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.556 1.142 . . . . 0.0 111.911 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -65.69 -51.1 62.04 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.41 0.684 . . . . 0.0 111.054 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.75 -33.88 74.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.229 0.611 . . . . 0.0 111.251 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -61.2 -50.2 74.09 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.067 0.547 . . . . 0.0 109.794 172.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.43 -40.63 95.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.545 0.338 . . . . 0.0 111.006 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.14 -46.72 85.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.646 0.778 . . . . 0.0 110.856 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -59.07 -52.54 65.29 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.547 0.739 . . . . 0.0 110.113 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.0 mm -51.48 -58.17 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.84 0.856 . . . . 0.0 110.875 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.23 -35.7 81.69 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.7 p -63.89 -45.59 88.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.357 0.526 . . . . 0.0 110.668 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 39.8 mt -59.76 -48.04 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 119.013 -0.517 . . . . 0.0 109.635 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 41.3 mtm105 -57.89 -37.73 74.52 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.758 0.708 . . . . 0.0 111.934 177.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -67.05 -49.38 65.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.968 0.507 . . . . 0.0 109.868 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.27 -48.76 80.42 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.378 1.071 . . . . 0.0 111.131 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.3 m -70.19 -36.18 74.45 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.139 1.376 . . . . 0.0 111.813 -177.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.065 0 O-C-N 122.031 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.154 0.025 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -117.73 -61.9 1.63 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.172 1.389 . . . . 0.0 111.613 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 75.6 mtm -90.39 -127.68 0.08 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.298 1.039 . . . . 0.0 110.54 -173.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -56.49 -40.77 75.5 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.337 1.055 . . . . 0.0 111.318 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.5 m -53.67 -37.95 63.68 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.741 1.216 . . . . 0.0 112.225 177.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -61.38 -45.21 95.31 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.77 -34.06 73.25 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.393 0.677 . . . . 0.0 110.785 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -63.29 -49.24 74.8 Favored 'General case' 0 C--N 1.341 0.224 0 C-N-CA 123.529 0.732 . . . . 0.0 110.135 173.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -59.14 -46.09 89.27 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.691 0.396 . . . . 0.0 111.151 176.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -57.31 -50.68 72.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.441 1.097 . . . . 0.0 110.681 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.91 -52.34 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.567 0.747 . . . . 0.0 110.686 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.67 -42.63 75.39 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.37 1.068 . . . . 0.0 111.597 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.55 -51.96 67.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.688 0.795 . . . . 0.0 110.005 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -91.57 62.98 4.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.777 0.831 . . . . 0.0 110.22 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -133.62 83.02 49.5 Favored Pre-proline 0 CA--C 1.536 0.44 0 C-N-CA 123.685 0.794 . . . . 0.0 109.47 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.38 -29.09 29.47 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 124.777 3.652 . . . . 0.0 114.798 -178.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -59.45 -29.68 67.97 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.794 0.838 . . . . 0.0 112.241 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.7 mt -89.51 165.1 14.5 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.338 0.655 . . . . 0.0 110.169 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.68 -165.58 1.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.215 1.006 . . . . 0.0 109.281 169.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -47.01 -75.81 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.293 1.437 . . . . 0.0 113.526 -170.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -60.51 -40.44 91.45 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -57.17 -52.83 63.75 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.943 0.897 . . . . 0.0 110.882 176.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.5 ttm-85 -61.06 -52.6 64.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.958 0.903 . . . . 0.0 110.313 -178.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -56.55 -42.56 78.76 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.908 0.483 . . . . 0.0 111.194 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.79 85.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.11 0.564 . . . . 0.0 111.436 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -62.12 -48.34 80.59 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.704 0.802 . . . . 0.0 109.841 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.88 -37.26 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.661 0.784 . . . . 0.0 110.297 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -61.73 -52.0 66.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.083 0.953 . . . . 0.0 110.327 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -59.15 -43.11 92.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.683 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.8 mt -60.58 -47.04 94.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 118.479 0.581 . . . . 0.0 109.931 176.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -55.13 -39.81 69.83 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 118.529 0.604 . . . . 0.0 111.904 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -67.64 -49.07 64.75 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 118.164 0.438 . . . . 0.0 110.14 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -60.36 -49.98 75.42 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.483 1.113 . . . . 0.0 111.248 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -75.22 -44.22 47.42 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.585 1.154 . . . . 0.0 111.472 -174.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.09 0 O-C-N 122.043 -0.411 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -168.26 -174.47 2.29 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.552 1.141 . . . . 0.0 109.295 -172.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.5 mtt -56.51 150.12 15.91 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.939 0.895 . . . . 0.0 110.435 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 76.57 -50.71 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.097 1.759 . . . . 0.0 111.454 -175.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.12 -55.47 33.43 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.532 0.605 . . . . 0.0 109.787 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -60.9 -37.9 83.84 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.502 0.721 . . . . 0.0 111.904 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -61.06 -49.72 76.2 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.54 0.736 . . . . 0.0 109.987 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.56 -37.2 86.01 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.536 0.735 . . . . 0.0 111.523 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -58.85 -54.77 43.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.771 0.714 . . . . 0.0 110.248 174.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -55.86 -49.04 74.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.941 1.296 . . . . 0.0 111.066 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -55.69 -53.43 56.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.829 1.252 . . . . 0.0 110.802 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.61 87.43 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.339 1.056 . . . . 0.0 111.478 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.35 -48.18 74.62 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.491 0.717 . . . . 0.0 109.316 175.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -94.68 41.74 1.09 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.81 0.844 . . . . 0.0 111.17 -177.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -117.77 90.47 36.28 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.215 1.006 . . . . 0.0 108.523 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.74 -25.57 20.28 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.042 2.494 . . . . 0.0 112.01 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -60.3 -35.79 76.39 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.778 0.831 . . . . 0.0 110.972 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.2 mt -89.37 140.01 29.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -89.08 -175.4 4.8 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.405 0.682 . . . . 0.0 109.658 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -51.42 -50.0 60.53 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.938 0.895 . . . . 0.0 111.471 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.4 -54.37 37.77 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.209 0.604 . . . . 0.0 111.199 -174.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -59.76 -45.33 92.57 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.63 0.772 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -57.54 -56.53 20.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.003 0.921 . . . . 0.0 110.241 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.64 -42.38 88.15 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.581 . . . . 0.0 111.179 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.07 -48.16 82.59 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.973 0.509 . . . . 0.0 110.97 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.44 -50.49 73.52 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.927 0.891 . . . . 0.0 110.692 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.8 mm -51.74 -52.72 20.4 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.146 0.978 . . . . 0.0 110.025 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -56.57 -49.1 75.86 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.166 0.586 . . . . 0.0 111.468 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -54.26 -51.51 64.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.985 0.514 . . . . 0.0 111.219 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.6 mt -60.03 -45.52 95.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.226 0.611 . . . . 0.0 110.053 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -57.55 -39.61 77.03 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 123.22 0.608 . . . . 0.0 111.685 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -69.2 -46.16 68.14 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.752 0.421 . . . . 0.0 109.883 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -58.85 -49.89 76.04 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.285 1.034 . . . . 0.0 111.075 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.0 m -73.37 -38.33 65.71 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.572 1.149 . . . . 0.0 111.703 -176.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.123 0 O-C-N 122.074 -0.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 111.278 0.103 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -162.18 -44.6 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.285 0.634 . . . . 0.0 111.541 -172.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptp -82.6 -161.15 0.44 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.685 1.194 . . . . 0.0 111.394 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -46.79 -28.56 1.58 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.92 1.688 . . . . 0.0 113.779 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -46.12 -45.79 16.69 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.341 1.457 . . . . 0.0 111.473 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.42 -49.22 75.15 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.84 0.856 . . . . 0.0 111.622 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.94 -42.4 90.09 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.151 0.98 . . . . 0.0 109.604 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -60.85 -44.93 96.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.352 1.061 . . . . 0.0 110.983 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -60.39 -50.42 73.66 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.253 0.621 . . . . 0.0 110.344 176.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -54.84 -51.49 65.73 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.932 0.893 . . . . 0.0 110.805 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -56.0 -54.48 44.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.757 0.823 . . . . 0.0 110.41 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.06 -40.68 73.93 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.391 1.076 . . . . 0.0 111.831 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -52.18 66.78 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -89.8 51.47 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.956 0.902 . . . . 0.0 110.358 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -119.38 81.32 22.51 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.283 1.033 . . . . 0.0 109.458 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.2 -20.3 24.91 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.203 2.602 . . . . 0.0 111.886 177.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -60.86 -37.01 80.63 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.851 0.861 . . . . 0.0 110.866 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -89.28 159.3 17.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.493 0.717 . . . . 0.0 109.413 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 -89.54 175.08 7.43 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.763 0.825 . . . . 0.0 108.81 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.38 -33.2 72.12 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.86 -63.2 1.38 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.806 0.843 . . . . 0.0 110.898 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.42 -35.47 81.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.805 0.442 . . . . 0.0 110.885 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.2 ttp-105 -61.2 -52.55 64.32 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.071 0.549 . . . . 0.0 111.108 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -63.88 -38.35 90.77 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.731 0.696 . . . . 0.0 110.946 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -42.96 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.752 0.421 . . . . 0.0 110.821 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -61.07 -48.85 79.82 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.71 0.804 . . . . 0.0 110.387 177.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.1 -49.64 60.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 123.426 0.691 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -58.18 -42.67 86.59 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.739 0.816 . . . . 0.0 111.253 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -59.68 -48.63 80.91 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 122.865 0.466 . . . . 0.0 111.263 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.15 -46.93 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 118.268 0.485 . . . . 0.0 109.971 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -61.31 -33.81 74.21 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.593 0.757 . . . . 0.0 111.815 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -70.83 -44.94 65.44 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.172 0.589 . . . . 0.0 110.143 175.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -58.47 -52.6 64.95 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.423 1.089 . . . . 0.0 110.716 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -47.83 68.28 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.818 0.447 . . . . 0.0 110.834 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.055 0 O-C-N 122.276 -0.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 44.2 p30 -163.28 169.91 18.43 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.677 1.191 . . . . 0.0 109.453 -173.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 82.0 mtp -81.92 60.52 4.81 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.611 0.764 . . . . 0.0 110.347 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 13.1 pt20 -163.66 -47.67 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.907 1.683 . . . . 0.0 109.112 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.5 m -68.93 -37.67 79.05 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 171.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -58.84 -42.63 89.74 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.835 0.454 . . . . 0.0 110.676 171.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 90.7 mtt-85 -63.25 -42.57 99.2 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.978 0.511 . . . . 0.0 110.416 177.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 9' ' ' GLN . 28.5 mmm180 -56.97 -51.12 70.49 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.052 0.541 . . . . 0.0 110.884 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -57.0 -52.62 64.56 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 122.571 0.348 . . . . 0.0 110.843 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -51.3 -59.73 3.9 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.349 1.06 . . . . 0.0 110.81 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -54.75 -48.42 72.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.759 0.824 . . . . 0.0 111.243 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.09 -45.95 86.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.748 0.819 . . . . 0.0 112.212 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.5 mt -59.77 -39.91 86.47 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.081 0.952 . . . . 0.0 111.942 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -89.2 -36.84 15.42 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.882 0.473 . . . . 0.0 111.543 -172.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.36 134.18 95.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.6 -126.48 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.945 2.43 . . . . 0.0 107.581 174.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 55.85 17.72 2.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.746 1.218 . . . . 0.0 113.289 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.3 mt -150.03 134.03 17.0 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.43 1.492 . . . . 0.0 107.64 -170.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.1 p30 -89.79 -176.36 4.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 169.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.79 -52.47 65.33 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.039 0.536 . . . . 0.0 111.195 -177.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -61.27 -53.33 58.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.289 0.636 . . . . 0.0 110.971 -174.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -62.39 -42.55 99.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.5 ttp85 -56.32 -61.46 2.39 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.013 0.525 . . . . 0.0 110.171 176.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -60.14 -35.87 76.24 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.251 -0.404 . . . . 0.0 111.986 -176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.69 -43.12 99.63 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.048 0.539 . . . . 0.0 111.295 175.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -69.64 -45.26 68.87 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 110.162 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.7 mm -54.47 -48.12 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.045 0.938 . . . . 0.0 110.017 172.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -58.14 -45.41 87.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.836 0.854 . . . . 0.0 110.911 177.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -57.68 -48.4 79.65 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.939 0.496 . . . . 0.0 111.057 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -57.96 -52.63 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.136 0.574 . . . . 0.0 109.64 176.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -57.28 -43.36 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.152 0.981 . . . . 0.0 112.065 -177.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.04 -47.86 73.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.391 0.677 . . . . 0.0 110.319 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -51.97 67.61 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.024 0.93 . . . . 0.0 111.374 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 72.4 m -69.53 -38.5 77.54 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.805 1.242 . . . . 0.0 111.282 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.099 0 O-C-N 122.199 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -159.27 178.32 10.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.849 0.86 . . . . 0.0 109.783 -178.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 79.5 mtm -43.63 -47.29 7.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.747 1.619 . . . . 0.0 112.764 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -69.13 -57.17 5.75 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.394 0.678 . . . . 0.0 111.329 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 m -61.72 -35.3 77.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.585 0.629 . . . . 0.0 111.862 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -59.89 -55.27 36.23 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.388 0.54 . . . . 0.0 111.678 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.67 -30.62 71.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.427 0.558 . . . . 0.0 111.882 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -65.69 -43.11 90.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.205 0.602 . . . . 0.0 110.798 174.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -59.63 -50.86 72.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.916 0.78 . . . . 0.0 110.348 174.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -54.75 -49.8 69.96 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.291 1.037 . . . . 0.0 110.637 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -55.81 -54.03 49.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.895 0.878 . . . . 0.0 110.354 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.88 -47.0 71.51 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.19 0.996 . . . . 0.0 112.166 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.6 mt -53.59 -39.4 64.83 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.983 0.913 . . . . 0.0 112.182 177.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -98.92 -20.07 17.0 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.79 0.836 . . . . 0.0 113.166 -169.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.76 122.95 79.77 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.414 0.686 . . . . 0.0 110.493 -173.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.49 -29.31 11.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.479 2.786 . . . . 0.0 112.668 -173.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -63.53 -28.3 69.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.464 0.705 . . . . 0.0 111.203 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.4 mt -89.63 128.48 36.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -88.8 -165.97 1.48 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.16 -51.32 70.21 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.918 0.487 . . . . 0.0 111.001 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -58.24 -57.29 13.51 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.15 0.98 . . . . 0.0 110.598 -177.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -56.48 -41.98 77.49 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.148 1.379 . . . . 0.0 110.881 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.87 -55.22 28.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.346 0.658 . . . . 0.0 109.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -58.07 -41.21 82.9 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.819 0.736 . . . . 0.0 111.326 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.85 -44.4 94.14 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.802 0.441 . . . . 0.0 111.204 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.44 -50.43 72.83 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.14 0.976 . . . . 0.0 110.472 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.1 mm -52.69 -49.36 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.867 0.867 . . . . 0.0 110.084 175.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.5 -47.52 76.09 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.049 0.94 . . . . 0.0 110.94 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.5 m -60.76 -41.22 95.02 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.414 0.686 . . . . 0.0 112.027 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.5 mt -67.66 -49.62 68.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.496 -177.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -65.62 -36.48 83.85 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 118.202 0.455 . . . . 0.0 111.7 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.19 -46.22 90.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.086 0.555 . . . . 0.0 110.602 172.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -58.16 -57.22 13.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.455 1.102 . . . . 0.0 111.595 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.63 -34.97 70.24 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.914 0.325 . . . . 0.0 111.807 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.104 0 O-C-N 121.971 -0.456 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 16.2 p30 -170.2 169.01 8.01 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.784 1.234 . . . . 0.0 109.278 -173.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.0 mmt -81.81 57.59 3.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 0.0 110.825 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -153.31 -53.82 0.11 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.23 1.812 . . . . 0.0 106.464 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.7 m -59.47 -43.86 93.16 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 124.082 0.953 . . . . 0.0 109.717 169.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -60.12 -43.79 95.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.125 0.57 . . . . 0.0 110.75 173.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -64.22 -37.6 88.07 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.187 0.595 . . . . 0.0 111.158 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -65.52 -46.38 79.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.119 0.968 . . . . 0.0 110.403 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.85 -54.79 42.94 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.285 0.493 . . . . 0.0 110.518 173.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -53.4 -48.4 68.72 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.777 1.631 . . . . 0.0 111.09 -177.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.09 -51.62 68.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.361 1.064 . . . . 0.0 110.782 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.98 -44.89 79.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.603 0.761 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -59.82 -52.71 64.28 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.823 0.849 . . . . 0.0 110.339 175.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -89.75 53.73 2.65 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.345 0.658 . . . . 0.0 110.501 -174.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -160.26 136.78 6.45 Favored Pre-proline 0 N--CA 1.453 -0.281 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -80.17 -129.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.845 2.363 . . . . 0.0 107.453 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 56.34 13.42 1.27 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.884 1.273 . . . . 0.0 113.429 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.5 mt -150.03 132.01 15.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.53 1.532 . . . . 0.0 107.392 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -89.8 -172.72 3.64 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -51.63 -52.56 46.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.374 0.669 . . . . 0.0 110.775 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -59.14 -56.83 17.1 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.701 0.8 . . . . 0.0 110.91 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -60.89 -40.46 93.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.898 0.879 . . . . 0.0 111.376 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.28 -57.3 13.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.569 0.748 . . . . 0.0 110.259 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -62.36 -35.7 79.95 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.256 -178.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.97 -43.76 98.16 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.049 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.22 -50.69 72.07 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.596 0.758 . . . . 0.0 110.299 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.17 -47.84 76.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 122.831 0.452 . . . . 0.0 110.106 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.9 tttp -58.42 -44.34 89.03 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.346 0.658 . . . . 0.0 111.247 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.4 m -61.68 -48.31 81.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.586 0.754 . . . . 0.0 111.084 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 49.8 mt -60.64 -47.63 92.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 123.587 0.755 . . . . 0.0 109.834 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 51.4 ttm-85 -64.21 -39.83 94.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.218 1.007 . . . . 0.0 111.674 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -65.0 -50.44 66.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.776 0.83 . . . . 0.0 110.355 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.76 -52.95 62.18 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.796 1.238 . . . . 0.0 111.216 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 94.9 m -70.83 -37.82 73.21 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.123 0.969 . . . . 0.0 111.733 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.093 0 O-C-N 122.094 -0.379 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 110.571 -0.159 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -74.57 178.59 5.24 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.928 0.491 . . . . 0.0 110.788 178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.2 ptp -52.77 -41.36 64.01 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.752 0.821 . . . . 0.0 112.578 -178.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -63.27 -43.83 96.82 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.193 0.451 . . . . 0.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.53 -45.56 86.66 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.93 0.492 . . . . 0.0 110.58 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -54.87 -54.46 42.18 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.689 0.796 . . . . 0.0 110.643 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.0 -42.71 80.79 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.88 1.272 . . . . 0.0 110.834 177.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.3 -51.32 70.43 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.135 0.974 . . . . 0.0 111.708 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -58.63 -52.47 65.55 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 118.068 0.395 . . . . 0.0 110.407 177.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -54.66 -51.3 65.9 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.186 0.994 . . . . 0.0 111.42 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.98 -53.38 59.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.618 1.167 . . . . 0.0 110.764 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -39.19 90.97 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.88 0.872 . . . . 0.0 112.117 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 mt -57.83 -52.0 67.29 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.042 0.537 . . . . 0.0 109.721 173.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.32 0.648 . . . . 0.0 110.139 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -126.03 92.86 45.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.689 1.195 . . . . 0.0 108.509 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -72.81 -28.21 13.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.051 2.5 . . . . 0.0 111.92 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -60.59 -33.01 72.09 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.974 0.91 . . . . 0.0 111.2 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.13 137.18 32.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -88.77 172.72 9.02 Favored 'General case' 0 C--N 1.338 0.085 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -50.92 -41.16 58.53 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.323 0.649 . . . . 0.0 112.524 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.36 -62.38 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.188 0.595 . . . . 0.0 110.93 -176.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -64.65 -37.57 88.01 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.233 0.613 . . . . 0.0 111.012 -176.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -59.83 -54.67 43.55 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.959 0.904 . . . . 0.0 110.619 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.99 -40.53 95.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.163 0.438 . . . . 0.0 110.94 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.06 91.02 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.048 0.539 . . . . 0.0 110.916 175.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -50.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.809 0.444 . . . . 0.0 110.237 178.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.2 mm -53.24 -46.25 56.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.177 0.991 . . . . 0.0 110.127 178.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.69 -46.99 87.4 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.586 0.754 . . . . 0.0 111.016 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.2 t -61.92 -47.96 82.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.437 0.695 . . . . 0.0 111.282 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.75 -45.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 124.329 1.052 . . . . 0.0 109.125 177.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -64.08 -40.86 97.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.896 0.878 . . . . 0.0 111.598 -178.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.96 -48.6 81.04 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.264 0.626 . . . . 0.0 110.417 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.07 -51.62 67.2 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.786 0.834 . . . . 0.0 111.514 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 93.7 m -68.18 -35.04 77.39 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.185 1.394 . . . . 0.0 112.157 -175.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.091 0 O-C-N 122.017 -0.427 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 120.271 0.081 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -175.77 -173.71 0.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.304 1.442 . . . . 0.0 109.159 -169.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 86.8 mmm -61.55 -38.85 88.98 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.086 0.954 . . . . 0.0 112.37 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -61.86 -50.45 72.18 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -57.73 -43.48 85.33 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.02 0.928 . . . . 0.0 111.29 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -56.92 -50.97 70.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.718 0.807 . . . . 0.0 110.674 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -63.35 -38.64 91.94 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.749 0.82 . . . . 0.0 111.659 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.7 mtp180 -62.03 -48.27 81.01 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.902 0.881 . . . . 0.0 110.458 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.88 -49.94 75.02 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.111 0.564 . . . . 0.0 111.031 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -57.64 -49.44 76.46 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.128 0.971 . . . . 0.0 110.883 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -55.92 -56.36 21.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.949 0.9 . . . . 0.0 110.15 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -40.65 76.86 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.186 0.994 . . . . 0.0 111.873 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 tp -60.09 -49.48 77.46 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.658 0.783 . . . . 0.0 109.812 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -93.39 58.44 2.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.75 0.82 . . . . 0.0 109.928 -178.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -129.11 86.89 55.78 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.803 0.841 . . . . 0.0 110.564 -178.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.57 -26.36 78.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 124.036 3.157 . . . . 0.0 113.318 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -55.39 -45.12 76.64 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.963 1.305 . . . . 0.0 111.855 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.0 mt -89.28 163.64 15.28 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.575 0.75 . . . . 0.0 109.644 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -89.41 -175.53 4.76 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.573 0.749 . . . . 0.0 109.37 174.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.3 -54.87 30.3 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 111.029 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -56.28 -52.86 62.95 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.567 0.747 . . . . 0.0 110.634 -179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.7 mm100 -60.65 -41.32 94.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 111.981 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ttp-105 -64.44 -46.97 80.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.084 0.554 . . . . 0.0 110.873 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -61.52 -39.08 89.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.106 0.412 . . . . 0.0 110.88 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.87 -44.05 97.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.957 0.503 . . . . 0.0 110.859 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -58.93 -50.59 73.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 0.0 110.507 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.0 mm -53.73 -47.75 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.704 0.802 . . . . 0.0 110.17 175.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.08 -45.2 93.69 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.568 0.747 . . . . 0.0 111.328 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -60.75 -45.57 93.78 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.645 0.778 . . . . 0.0 111.197 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.63 -47.33 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 123.426 0.691 . . . . 0.0 109.638 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -62.26 -43.29 99.16 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.613 0.765 . . . . 0.0 111.853 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.8 -50.82 70.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.842 0.857 . . . . 0.0 110.571 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.82 -53.51 57.41 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.643 1.177 . . . . 0.0 111.282 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.6 m -73.35 -29.44 62.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.33 1.052 . . . . 0.0 112.293 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.098 0 O-C-N 121.863 -0.523 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 . . . . . 0 N--CA 1.474 0.764 0 CA-C-O 120.733 0.301 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -87.48 -175.93 5.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.887 0.875 . . . . 0.0 110.62 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.5 tpt -59.47 -39.01 82.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.73 0.812 . . . . 0.0 112.101 -177.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -56.52 -48.99 76.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.159 0.584 . . . . 0.0 110.135 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.84 -36.36 78.08 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.666 0.787 . . . . 0.0 111.732 -178.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.9 tm0? -56.0 -53.02 61.93 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.415 0.686 . . . . 0.0 109.995 170.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -59.16 -41.76 89.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.165 0.986 . . . . 0.0 111.395 179.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -61.48 -49.39 76.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.364 0.666 . . . . 0.0 111.009 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -56.23 -56.08 25.42 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.232 0.469 . . . . 0.0 110.391 176.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -53.33 -52.77 58.1 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.209 1.404 . . . . 0.0 110.917 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -54.73 -55.76 26.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.165 0.986 . . . . 0.0 110.292 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.81 -44.28 70.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.708 0.803 . . . . 0.0 111.853 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.56 -46.85 63.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.069 1.348 . . . . 0.0 110.679 178.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -89.73 -30.8 17.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.669 0.788 . . . . 0.0 112.782 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -57.01 110.79 2.66 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 111.926 -169.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.15 -22.44 22.47 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.055 2.503 . . . . 0.0 112.126 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -61.3 -27.61 68.6 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.19 0.596 . . . . 0.0 111.011 175.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -89.61 132.36 35.15 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 172.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.4 p30 -89.18 -174.18 4.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 171.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.56 -44.02 68.93 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.54 0.736 . . . . 0.0 112.672 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.57 -59.83 3.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.365 1.066 . . . . 0.0 109.954 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -52.87 -46.68 68.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.927 1.291 . . . . 0.0 110.63 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 ttp-105 -61.97 -57.13 12.88 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.329 1.052 . . . . 0.0 111.327 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -61.22 -41.38 96.76 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.277 0.944 . . . . 0.0 111.077 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.71 -46.56 81.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.419 0.688 . . . . 0.0 111.016 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.69 -48.48 81.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.094 0.958 . . . . 0.0 110.91 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.7 mm -55.06 -49.43 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 122.901 0.481 . . . . 0.0 110.0 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -59.85 -40.95 90.31 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.929 0.492 . . . . 0.0 111.87 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -60.74 -46.91 88.63 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.92 0.488 . . . . 0.0 110.821 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 33.1 mt -64.94 -41.19 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.642 0.777 . . . . 0.0 109.766 178.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -57.12 -48.3 79.0 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.15 0.98 . . . . 0.0 110.565 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -63.76 -57.45 9.92 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.528 0.731 . . . . 0.0 110.635 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -50.25 -56.06 12.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.482 1.513 . . . . 0.0 111.977 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -91.87 10.82 27.12 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.664 1.185 . . . . 0.0 113.069 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.001 0 O-C-N 121.604 -0.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -72.08 169.11 16.71 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.811 0.444 . . . . 0.0 110.901 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -56.18 -42.67 77.46 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.92 0.888 . . . . 0.0 112.704 -175.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -66.08 -49.3 68.08 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.766 0.426 . . . . 0.0 110.435 -176.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.8 m -58.21 -45.02 88.39 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.032 0.533 . . . . 0.0 110.411 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -58.53 -48.49 80.67 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.665 0.786 . . . . 0.0 111.412 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -55.81 -48.51 75.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.263 1.025 . . . . 0.0 110.57 175.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.2 mtp180 -60.35 -47.15 87.3 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.178 0.591 . . . . 0.0 111.244 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -57.52 -51.14 70.67 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.495 0.718 . . . . 0.0 110.552 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -54.78 -58.96 5.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.386 1.074 . . . . 0.0 110.619 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -53.99 -51.11 64.98 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.53 0.732 . . . . 0.0 111.048 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.76 -49.1 76.27 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.618 0.767 . . . . 0.0 111.509 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.9 -43.14 65.96 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.67 1.188 . . . . 0.0 111.743 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -89.71 -22.64 22.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.441 0.696 . . . . 0.0 112.602 -174.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.95 114.64 6.74 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.241 1.016 . . . . 0.0 111.097 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -76.81 -28.42 6.33 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.094 2.529 . . . . 0.0 111.934 -177.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -56.09 -42.26 76.47 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 124.821 1.249 . . . . 0.0 112.126 -173.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.3 mt -89.26 139.4 30.53 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -88.77 -177.69 5.59 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.023 0.929 . . . . 0.0 108.916 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -46.99 -51.95 15.91 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.793 0.837 . . . . 0.0 112.056 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -63.14 -56.47 16.5 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.564 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -66.86 -43.29 83.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.287 0.635 . . . . 0.0 110.942 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -60.92 -49.46 77.37 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.832 0.853 . . . . 0.0 110.298 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -63.42 -41.67 98.7 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.804 0.842 . . . . 0.0 110.258 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.85 -38.3 75.42 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.569 0.347 . . . . 0.0 111.178 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -62.36 -46.98 86.23 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 110.065 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.7 mm -55.55 -48.23 77.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.084 0.554 . . . . 0.0 110.151 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -57.37 -42.07 81.38 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.75 0.42 . . . . 0.0 111.383 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 m -62.19 -44.08 97.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.235 0.614 . . . . 0.0 111.465 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.66 -45.82 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -60.99 -38.17 85.03 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.671 0.788 . . . . 0.0 111.645 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -66.01 -47.63 73.84 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.453 0.701 . . . . 0.0 110.381 174.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -58.08 -54.6 45.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.4 1.08 . . . . 0.0 111.307 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -47.26 79.7 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.149 0.58 . . . . 0.0 111.553 176.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.113 0 O-C-N 122.311 -0.243 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -155.53 179.26 9.35 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.151 0.98 . . . . 0.0 110.194 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.9 tpp -58.31 -37.42 75.06 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.976 1.31 . . . . 0.0 111.749 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -62.51 -50.31 71.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.344 0.658 . . . . 0.0 110.591 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.7 -51.74 67.61 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.77 0.428 . . . . 0.0 111.442 174.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -50.84 -55.9 14.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.597 1.159 . . . . 0.0 110.82 -178.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -55.82 -53.9 51.08 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.57 0.748 . . . . 0.0 111.091 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -59.9 -45.5 92.36 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.888 -176.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.1 -56.85 16.41 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.135 0.574 . . . . 0.0 110.281 176.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -49.63 -56.75 8.93 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -55.51 -51.11 68.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.998 0.919 . . . . 0.0 110.919 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.48 87.69 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.619 0.768 . . . . 0.0 112.227 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.5 mt -58.33 -44.67 88.78 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.009 0.924 . . . . 0.0 111.837 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -89.35 -43.61 10.79 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.874 0.47 . . . . 0.0 111.749 -170.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.84 136.27 90.15 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 109.744 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.54 -127.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.864 2.376 . . . . 0.0 107.717 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 54.72 15.62 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.787 1.235 . . . . 0.0 113.49 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.5 mt -150.0 133.18 16.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.431 1.493 . . . . 0.0 107.635 -170.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -89.41 170.79 10.23 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 170.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -48.43 -57.41 6.12 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.282 1.033 . . . . 0.0 112.302 -173.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -57.45 -48.61 78.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.576 0.75 . . . . 0.0 111.35 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -68.54 -35.08 76.94 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.678 0.791 . . . . 0.0 111.533 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -67.33 -48.27 68.04 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.162 0.437 . . . . 0.0 109.859 177.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -59.42 -39.87 84.9 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.615 0.366 . . . . 0.0 111.019 174.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.05 -39.97 94.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.972 0.509 . . . . 0.0 111.303 176.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.5 -50.74 71.49 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.449 0.7 . . . . 0.0 110.196 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.8 mm -55.01 -48.64 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 122.99 0.516 . . . . 0.0 110.388 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -58.71 -45.45 89.51 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.014 0.526 . . . . 0.0 111.197 178.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.5 t -59.24 -46.74 87.68 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.629 0.771 . . . . 0.0 111.023 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -49.3 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 123.983 0.913 . . . . 0.0 109.945 177.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -57.19 -39.45 75.41 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.876 1.271 . . . . 0.0 111.953 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.67 -45.82 67.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.118 0.567 . . . . 0.0 110.344 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.89 -51.46 67.5 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.56 1.144 . . . . 0.0 111.054 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.43 -47.16 64.95 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.338 0.655 . . . . 0.0 110.39 178.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.079 0 CA-C-N 116.733 -0.212 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 111.477 0.176 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -161.38 169.11 22.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.335 1.054 . . . . 0.0 109.807 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -46.35 -44.24 16.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.447 1.499 . . . . 0.0 114.047 -173.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -65.36 -41.59 93.68 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.385 0.539 . . . . 0.0 110.68 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 m -64.74 -49.11 72.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.349 0.66 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -61.13 -44.55 97.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.914 0.486 . . . . 0.0 111.217 179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -55.17 -51.01 67.85 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.806 1.242 . . . . 0.0 110.56 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -66.46 -38.97 88.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.718 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -58.19 -56.61 19.88 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.848 0.749 . . . . 0.0 110.01 174.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -51.81 -50.74 60.23 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.34 1.456 . . . . 0.0 110.743 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -55.96 -55.17 35.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.739 0.816 . . . . 0.0 110.665 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.23 -39.62 75.91 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.988 0.915 . . . . 0.0 112.121 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.43 -47.71 78.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.79 1.236 . . . . 0.0 110.489 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -89.36 -30.59 18.29 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.484 0.714 . . . . 0.0 111.912 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.11 123.9 67.29 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 124.648 1.179 . . . . 0.0 109.684 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -79.96 -135.98 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.961 2.441 . . . . 0.0 106.151 170.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.6 m120 70.18 -52.24 0.64 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.183 1.793 . . . . 0.0 112.407 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -88.88 151.7 22.18 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 126.269 1.828 . . . . 0.0 108.552 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -89.47 -174.64 4.43 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 172.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -58.18 -46.46 85.71 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.795 0.838 . . . . 0.0 111.717 -175.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -64.57 -48.86 73.43 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.879 -176.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -67.5 -35.09 78.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.166 0.586 . . . . 0.0 111.51 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -61.06 -51.4 69.32 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 172.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -59.94 -37.06 78.41 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.992 0.517 . . . . 0.0 111.122 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.29 97.84 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.402 0.681 . . . . 0.0 110.948 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -59.57 -52.09 67.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.466 0.707 . . . . 0.0 110.253 176.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.6 mm -52.96 -51.09 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.109 0.564 . . . . 0.0 109.98 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -57.33 -46.07 83.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.535 1.134 . . . . 0.0 111.656 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 p -64.41 -38.14 89.98 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.136 0.426 . . . . 0.0 111.672 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.69 -45.34 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.16 -40.91 82.62 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.557 0.743 . . . . 0.0 111.097 176.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.87 -51.18 63.39 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.515 0.726 . . . . 0.0 110.582 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.69 -50.32 66.12 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.076 1.351 . . . . 0.0 111.272 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.1 m -74.73 -38.79 62.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.433 1.093 . . . . 0.0 111.777 -176.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.738 0.304 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -95.79 -57.06 2.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.475 1.11 . . . . 0.0 113.456 -169.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.1 tpt -90.8 -100.24 0.11 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.403 0.681 . . . . 0.0 110.82 -171.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -76.06 -22.78 55.29 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 -169.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 58.6 m -59.6 -55.57 32.82 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.372 1.069 . . . . 0.0 110.686 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -67.88 -34.55 76.89 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -61.09 -47.86 84.35 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.929 0.492 . . . . 0.0 109.865 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.34 -41.49 96.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 118.495 -0.765 . . . . 0.0 111.393 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.18 -52.02 64.67 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.083 0.856 . . . . 0.0 110.341 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -55.46 -57.45 11.85 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.613 1.165 . . . . 0.0 110.696 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -54.18 -51.55 64.0 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.175 0.59 . . . . 0.0 111.102 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.55 -46.87 85.94 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.692 0.797 . . . . 0.0 111.649 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.27 -43.49 67.49 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.747 1.219 . . . . 0.0 111.47 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -89.54 -19.24 25.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.18 0.592 . . . . 0.0 112.31 -175.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.33 120.01 44.32 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 123.535 0.734 . . . . 0.0 110.783 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -81.17 -28.96 2.17 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.444 2.763 . . . . 0.0 111.955 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -55.89 -40.98 73.77 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.697 -174.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.0 mt -89.17 130.55 35.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 172.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -89.0 -178.82 5.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 178.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -41.4 -63.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.193 1.397 . . . . 0.0 113.528 -171.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.11 -44.65 91.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -64.85 -44.87 88.38 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.785 0.834 . . . . 0.0 110.645 -178.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -63.21 -47.61 81.8 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.483 1.513 . . . . 0.0 110.378 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -59.65 -42.34 92.55 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.382 0.673 . . . . 0.0 110.674 176.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.5 -38.05 85.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.623 0.369 . . . . 0.0 111.084 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -62.1 -49.98 73.77 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.673 0.789 . . . . 0.0 109.988 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 34.4 mm -53.62 -47.43 61.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.833 0.853 . . . . 0.0 110.221 174.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -56.93 -46.27 82.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.874 0.87 . . . . 0.0 110.927 178.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.0 m -60.81 -41.3 95.43 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.626 0.77 . . . . 0.0 111.779 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 46.8 mt -63.23 -52.11 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 118.15 0.432 . . . . 0.0 110.284 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -67.99 -33.79 75.3 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.12 -51.63 68.77 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.361 0.664 . . . . 0.0 110.496 172.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -56.98 -51.28 69.83 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.961 1.304 . . . . 0.0 111.094 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.67 -44.42 86.33 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.369 1.067 . . . . 0.0 111.769 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.163 0 O-C-N 122.193 -0.317 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.67 173.39 3.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.514 1.126 . . . . 0.0 111.06 174.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.44 166.32 3.15 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.15 0.58 . . . . 0.0 111.628 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.4 -59.89 0.51 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.966 2.106 . . . . 0.0 110.659 -171.383 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.2 m -54.9 -54.3 44.39 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.636 0.774 . . . . 0.0 109.165 170.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -53.4 -41.46 65.99 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.371 1.068 . . . . 0.0 111.593 177.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -64.34 -49.1 73.03 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 122.674 0.39 . . . . 0.0 110.762 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -57.88 -47.08 83.79 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.037 177.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -55.7 -57.87 10.19 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.946 0.498 . . . . 0.0 110.91 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -50.37 -58.79 4.9 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.425 1.49 . . . . 0.0 111.19 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.75 -51.28 69.47 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.548 0.739 . . . . 0.0 110.899 -178.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.39 -41.54 72.8 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.401 0.68 . . . . 0.0 112.002 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -57.26 -48.26 79.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.273 1.029 . . . . 0.0 110.46 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -89.09 -23.88 22.41 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -169.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.59 123.24 70.04 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 118.525 0.602 . . . . 0.0 111.002 -172.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.13 -30.89 6.5 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.436 2.757 . . . . 0.0 112.37 -174.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -63.09 -27.51 69.44 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.603 0.761 . . . . 0.0 111.345 -179.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 mp -88.94 125.68 35.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p-10 -88.9 -172.13 3.57 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.16 -42.22 65.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.997 0.519 . . . . 0.0 112.01 178.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.03 -60.85 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.675 0.79 . . . . 0.0 110.886 -176.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -60.32 -39.72 88.01 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.38 0.672 . . . . 0.0 110.536 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 ttp85 -58.69 -61.13 2.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.754 0.822 . . . . 0.0 110.263 177.802 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -61.01 -38.5 86.29 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 119.123 0.874 . . . . 0.0 111.439 -174.693 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -43.78 92.52 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.677 0.791 . . . . 0.0 111.347 174.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -49.23 69.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.495 0.718 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 31.0 mm -56.02 -40.81 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.95 0.9 . . . . 0.0 109.996 176.471 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -62.32 -48.33 80.32 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.517 0.727 . . . . 0.0 110.852 175.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 m -56.53 -48.74 76.61 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.089 0.556 . . . . 0.0 111.005 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.0 mt -64.67 -39.94 87.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.01 0.524 . . . . 0.0 109.982 -178.842 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -57.16 -41.3 78.92 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.962 0.801 . . . . 0.0 111.538 172.217 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -67.78 -43.77 78.99 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.078 0.399 . . . . 0.0 110.11 -178.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.4 -58.05 7.57 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.557 1.143 . . . . 0.0 111.237 -179.286 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.7 m -76.48 -41.01 48.63 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.729 1.212 . . . . 0.0 111.599 -173.29 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.07 0 O-C-N 122.039 -0.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -161.91 -174.02 3.96 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.886 1.274 . . . . 0.0 109.351 -179.345 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.4 ppp? -51.81 -36.65 48.7 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.355 1.062 . . . . 0.0 112.931 179.0 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -65.3 -44.66 87.22 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.963 0.505 . . . . 0.0 110.653 179.08 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.39 -42.44 96.13 Favored 'General case' 0 C--N 1.338 0.08 0 C-N-CA 123.438 0.695 . . . . 0.0 110.666 177.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -57.78 -48.54 79.38 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.685 0.794 . . . . 0.0 110.569 175.778 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -58.41 -46.41 86.49 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.023 0.929 . . . . 0.0 111.251 176.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 -59.77 -47.76 84.38 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.46 0.704 . . . . 0.0 111.119 179.357 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -58.03 -56.51 21.13 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 122.916 0.486 . . . . 0.0 110.468 176.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -50.44 -51.58 45.41 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.58 1.152 . . . . 0.0 110.9 -179.312 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -56.39 -57.95 10.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.782 0.833 . . . . 0.0 110.514 178.013 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.92 -44.65 74.43 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.093 0.957 . . . . 0.0 112.381 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.5 mt -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.066 0.947 . . . . 0.0 111.583 178.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -89.67 -23.15 21.94 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.242 0.617 . . . . 0.0 112.284 -172.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -60.79 126.4 85.3 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 124.194 0.997 . . . . 0.0 109.828 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.16 -129.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.1 2.533 . . . . 0.0 106.428 170.799 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.1 m120 70.42 -55.76 0.61 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.45 1.9 . . . . 0.0 113.472 175.361 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.3 mt -88.85 166.42 14.0 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.104 1.762 . . . . 0.0 109.193 -177.016 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -89.6 -177.8 5.39 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.039 0.536 . . . . 0.0 109.566 171.448 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -60.56 -55.32 34.82 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.072 0.949 . . . . 0.0 110.853 -175.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -58.8 -49.05 79.14 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.942 0.897 . . . . 0.0 111.34 -176.65 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.88 -46.12 90.33 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.984 0.514 . . . . 0.0 111.232 178.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.8 ttp-105 -64.31 -50.69 66.83 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.955 0.502 . . . . 0.0 111.645 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -63.93 -39.05 93.26 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 118.708 0.685 . . . . 0.0 111.57 179.325 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.62 -38.16 69.13 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.976 0.51 . . . . 0.0 110.987 171.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.12 -45.62 92.68 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.468 0.707 . . . . 0.0 110.366 174.904 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.6 mm -56.64 -48.53 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 122.966 0.506 . . . . 0.0 110.221 175.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -56.62 -46.18 81.08 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.001 0.52 . . . . 0.0 110.876 176.616 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -58.06 -47.62 82.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.57 0.748 . . . . 0.0 111.623 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -58.54 -49.44 82.34 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 176.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -61.82 -41.23 97.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.672 0.789 . . . . 0.0 111.984 -176.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -63.89 -52.1 61.49 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.079 0.952 . . . . 0.0 110.396 176.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.86 -51.96 65.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.638 1.175 . . . . 0.0 111.443 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 97.8 m -75.65 -29.96 59.29 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.654 1.181 . . . . 0.0 112.234 -175.365 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.07 0 O-C-N 122.003 -0.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 119.593 -0.241 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -89.13 -175.23 4.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.598 0.759 . . . . 0.0 109.665 174.03 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.4 tpt -45.7 -47.14 15.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.183 1.393 . . . . 0.0 111.796 177.456 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -71.05 -63.85 1.02 Allowed 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.007 0.923 . . . . 0.0 110.374 -178.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 93.1 m -60.57 -38.55 84.93 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.246 1.018 . . . . 0.0 112.37 -170.212 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -51.39 -52.74 43.23 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.612 0.765 . . . . 0.0 110.221 173.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -67.58 -36.44 80.91 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.785 0.834 . . . . 0.0 111.443 -177.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -60.44 -52.85 63.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 175.507 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -57.98 -52.38 65.77 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.224 0.609 . . . . 0.0 110.973 178.516 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -55.24 -51.61 66.03 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.882 1.273 . . . . 0.0 111.074 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -57.35 -51.69 68.36 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.959 0.904 . . . . 0.0 110.642 178.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.52 -39.52 76.73 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.87 0.868 . . . . 0.0 111.89 179.668 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.21 70.55 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 175.618 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.561 0.744 . . . . 0.0 110.139 -176.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -129.84 77.07 77.44 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.366 1.067 . . . . 0.0 109.051 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -70.05 -14.78 35.59 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.441 2.761 . . . . 0.0 112.463 -179.395 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -59.46 -36.26 75.63 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 110.047 173.08 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.34 146.31 24.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.243 1.017 . . . . 0.0 108.279 172.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -88.65 179.93 6.16 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -47.77 -51.32 22.82 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.853 1.261 . . . . 0.0 111.754 -178.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.02 -59.28 5.68 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.361 1.064 . . . . 0.0 111.16 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -55.06 -43.19 73.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.36 1.064 . . . . 0.0 111.29 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.8 ttp180 -64.82 -50.62 65.98 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 111.101 -177.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -63.49 -40.14 96.3 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.977 0.808 . . . . 0.0 111.352 178.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.59 88.55 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.443 0.697 . . . . 0.0 110.942 175.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -63.02 -47.86 81.22 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.894 0.877 . . . . 0.0 110.588 177.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.1 mm -54.47 -47.46 70.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.146 0.578 . . . . 0.0 110.525 175.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -61.51 -43.51 98.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.568 0.747 . . . . 0.0 111.363 178.724 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.6 m -60.31 -49.24 78.37 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.214 0.606 . . . . 0.0 110.684 178.232 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.1 mt -57.04 -44.77 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 123.626 0.771 . . . . 0.0 109.38 175.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -64.0 -34.72 78.64 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.309 0.644 . . . . 0.0 111.953 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -68.41 -47.86 66.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.142 0.577 . . . . 0.0 109.855 176.602 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -59.1 -49.81 76.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.235 1.014 . . . . 0.0 111.146 178.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 84.3 m -72.97 -44.25 61.31 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.279 1.432 . . . . 0.0 111.407 -175.138 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.055 0 O-C-N 122.054 -0.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.642 0.258 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 p-10 -106.12 -166.69 1.22 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.148 1.379 . . . . 0.0 110.738 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.0 tpt -60.83 -40.84 94.3 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.777 0.831 . . . . 0.0 111.26 177.595 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.34 -42.02 97.99 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.849 0.46 . . . . 0.0 110.971 177.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 90.8 m -63.48 -44.28 94.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.032 0.533 . . . . 0.0 110.762 176.147 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -58.26 -49.8 75.83 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.879 0.472 . . . . 0.0 110.882 177.004 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -54.19 -51.82 63.16 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.336 1.055 . . . . 0.0 110.506 175.265 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -52.79 -48.89 66.54 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.914 1.285 . . . . 0.0 111.391 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -60.9 -53.21 60.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.519 0.328 . . . . 0.0 111.178 176.588 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -54.13 -58.84 5.83 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.994 0.918 . . . . 0.0 111.077 -176.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.41 -45.16 94.6 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.567 -176.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.99 92.05 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.266 0.484 . . . . 0.0 111.455 179.133 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.25 -46.18 79.73 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.743 1.217 . . . . 0.0 111.473 -178.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -89.2 -28.56 19.89 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.059 0.544 . . . . 0.0 111.808 -171.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.88 122.07 59.45 Favored Pre-proline 0 CA--C 1.532 0.277 0 C-N-CA 123.674 0.79 . . . . 0.0 110.175 177.095 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -80.94 -132.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.106 2.537 . . . . 0.0 106.106 169.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 70.55 -50.95 0.67 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.431 1.892 . . . . 0.0 113.073 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.1 mt -88.77 162.04 16.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.883 1.673 . . . . 0.0 108.554 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -90.07 178.64 6.14 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.928 0.394 . . . . 0.0 110.579 175.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.05 -41.09 82.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.925 0.89 . . . . 0.0 111.394 179.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.16 -58.06 10.32 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.35 0.66 . . . . 0.0 110.573 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -55.56 -49.94 71.36 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.828 1.251 . . . . 0.0 110.897 179.132 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 ttp-105 -67.42 -42.41 83.24 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.439 0.695 . . . . 0.0 112.137 -173.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -70.88 -39.18 72.98 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.937 0.789 . . . . 0.0 110.543 178.48 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.2 -40.26 89.47 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.631 0.773 . . . . 0.0 111.298 175.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -58.97 -51.98 67.73 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.67 0.788 . . . . 0.0 109.758 174.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mt -57.5 -40.74 76.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 118.202 0.455 . . . . 0.0 111.52 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -61.02 -42.98 99.5 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 176.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.6 m -64.02 -44.36 92.81 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.632 0.773 . . . . 0.0 111.014 178.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.6 mt -62.15 -49.23 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.2 mtp-105 -52.66 -50.1 63.9 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.97 0.908 . . . . 0.0 111.327 175.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -58.97 -50.51 73.79 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.525 0.73 . . . . 0.0 111.023 -178.703 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.64 -52.21 65.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.37 1.068 . . . . 0.0 111.508 -179.19 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 88.1 m -71.91 -30.52 65.45 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.238 1.415 . . . . 0.0 112.264 -173.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.077 0 O-C-N 122.141 -0.349 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 . . . . . 0 CA--C 1.53 0.184 0 N-CA-C 110.686 -0.116 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.9 m -66.24 -45.0 82.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.077 0.951 . . . . 0.0 110.041 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -54.85 -53.83 50.22 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.08 0.952 . . . . 0.0 110.52 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -60.62 -43.55 97.35 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.689 0.796 . . . . 0.0 111.389 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.4 mtp85 -60.6 -45.48 93.84 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.466 0.706 . . . . 0.0 111.206 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -59.19 -52.58 65.07 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.278 0.49 . . . . 0.0 110.296 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -53.85 -48.74 69.68 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.17 0.988 . . . . 0.0 111.096 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -59.15 -53.28 60.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.645 0.778 . . . . 0.0 110.786 176.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.25 77.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.252 1.021 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.42 -53.84 52.69 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.411 0.685 . . . . 0.0 109.708 173.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -89.99 59.72 4.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.612 0.765 . . . . 0.0 110.136 -174.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -133.21 81.33 56.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.698 0.799 . . . . 0.0 110.226 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -54.78 -29.03 60.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 124.541 3.494 . . . . 0.0 114.125 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -58.72 -32.74 69.47 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.86 0.864 . . . . 0.0 111.594 -178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.6 mt -89.47 153.34 20.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.65 0.78 . . . . 0.0 109.393 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -89.53 -177.65 5.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.35 -51.43 69.44 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.541 0.736 . . . . 0.0 111.431 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -61.04 -51.95 67.02 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.899 0.88 . . . . 0.0 110.383 -174.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.87 -50.85 69.5 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.692 1.197 . . . . 0.0 110.883 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -59.24 -51.4 70.13 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.896 0.878 . . . . 0.0 111.06 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -59.13 -40.09 84.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.093 0.557 . . . . 0.0 111.362 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.654 0.382 . . . . 0.0 111.086 174.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -62.89 -50.7 69.86 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 109.96 178.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.2 mm -53.92 -48.81 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.277 1.031 . . . . 0.0 109.978 175.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -58.0 -43.41 86.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.871 0.869 . . . . 0.0 111.093 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -61.89 -47.18 86.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.36 0.664 . . . . 0.0 111.286 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.2 mt -57.41 -50.76 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -62.1 -43.24 99.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.875 0.87 . . . . 0.0 111.723 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.14 -51.45 69.01 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.919 0.888 . . . . 0.0 110.604 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.99 -52.78 64.31 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.316 1.046 . . . . 0.0 111.392 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.2 m . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 124.6 1.16 . . . . 0.0 112.347 -175.343 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 tm0? . . . . . 0 N--CA 1.454 -0.247 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.8 m -59.54 -44.64 93.16 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.803 0.841 . . . . 0.0 109.57 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -49.92 -51.85 37.75 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.521 1.128 . . . . 0.0 111.265 173.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -65.03 -40.25 94.57 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.48 0.712 . . . . 0.0 110.893 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -61.4 -48.29 81.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.252 0.621 . . . . 0.0 110.881 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -57.13 -50.14 73.72 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.229 0.612 . . . . 0.0 110.744 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -57.12 -52.36 65.6 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.08 0.952 . . . . 0.0 110.882 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -55.68 -54.03 49.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.683 0.793 . . . . 0.0 110.751 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.6 -47.63 76.2 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.053 0.941 . . . . 0.0 111.354 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 tp -55.39 -39.25 69.92 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.538 1.135 . . . . 0.0 111.382 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -103.01 20.9 16.7 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.606 0.762 . . . . 0.0 111.987 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -80.16 119.64 77.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 118.697 0.681 . . . . 0.0 110.132 -176.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.18 -28.69 2.3 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.346 2.697 . . . . 0.0 112.128 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -60.87 -41.07 95.25 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.67 1.188 . . . . 0.0 112.076 -172.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.22 162.41 15.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.018 0.927 . . . . 0.0 110.086 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -89.85 -179.47 5.74 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.714 0.806 . . . . 0.0 108.983 169.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.94 -50.15 67.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -60.61 -55.48 32.79 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.045 0.538 . . . . 0.0 111.345 -173.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.02 -36.82 84.3 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.82 0.448 . . . . 0.0 111.36 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.2 ttp-105 -60.88 -49.26 78.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.932 0.493 . . . . 0.0 110.762 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -60.64 -39.39 88.1 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.176 0.59 . . . . 0.0 110.949 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.65 -38.68 88.63 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 117.962 0.347 . . . . 0.0 111.125 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -64.83 -49.81 69.14 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.794 0.838 . . . . 0.0 109.971 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.0 mm -52.84 -47.31 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.408 1.083 . . . . 0.0 110.178 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -59.44 -46.76 87.83 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.452 0.701 . . . . 0.0 110.833 178.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -59.01 -44.57 91.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 111.402 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.41 -47.91 86.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.2 ttm105 -60.34 -42.55 95.93 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.947 0.499 . . . . 0.0 111.888 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -61.98 -48.98 77.92 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.29 0.636 . . . . 0.0 110.461 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -60.51 -54.29 47.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.387 1.075 . . . . 0.0 111.407 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 96.9 m . . . . . 0 N--CA 1.455 -0.201 0 C-N-CA 124.562 1.145 . . . . 0.0 111.65 -173.343 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 CA--C 1.529 0.144 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.3 m -61.24 -43.9 98.12 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.21 1.004 . . . . 0.0 109.568 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.64 -44.66 96.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.887 0.875 . . . . 0.0 110.952 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -61.16 -46.93 88.51 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.966 0.906 . . . . 0.0 110.618 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -60.55 -46.05 91.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.689 1.196 . . . . 0.0 110.871 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -58.5 -52.95 63.49 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.738 0.415 . . . . 0.0 110.462 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -56.33 -48.25 77.12 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.08 0.952 . . . . 0.0 111.138 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.98 -59.02 5.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.099 0.96 . . . . 0.0 110.346 177.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -47.18 73.34 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.208 1.003 . . . . 0.0 111.716 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 43.4 tp -55.52 -29.28 58.59 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.381 1.472 . . . . 0.0 112.466 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -116.3 16.38 15.79 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.87 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -77.39 119.54 77.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-O 118.669 -0.682 . . . . 0.0 109.647 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.63 -37.18 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.986 2.457 . . . . 0.0 111.814 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -63.71 -38.76 92.31 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.304 1.042 . . . . 0.0 111.399 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -89.15 137.22 32.52 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -89.08 -173.34 4.02 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.55 0.74 . . . . 0.0 109.313 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.59 -42.83 79.37 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.864 0.465 . . . . 0.0 112.115 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.02 -57.01 12.13 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.683 0.793 . . . . 0.0 110.309 -177.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.75 -44.24 93.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.048 0.939 . . . . 0.0 110.924 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -55.36 -56.13 23.66 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.309 1.043 . . . . 0.0 110.109 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.67 -43.05 75.96 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.381 0.673 . . . . 0.0 111.255 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.51 -38.15 80.17 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.94 0.496 . . . . 0.0 111.416 174.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -66.13 -50.37 64.21 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.929 0.892 . . . . 0.0 110.534 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.0 mm -57.74 -41.12 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.093 0.557 . . . . 0.0 109.932 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -61.54 -46.19 90.97 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.261 0.624 . . . . 0.0 111.481 176.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.7 p -63.13 -42.03 99.42 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.172 0.442 . . . . 0.0 111.358 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 54.5 mt -63.79 -53.0 50.01 Favored 'Isoleucine or valine' 0 C--N 1.342 0.253 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -61.97 -38.79 89.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.277 0.49 . . . . 0.0 111.153 -175.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.77 -53.46 53.99 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.855 0.862 . . . . 0.0 110.805 175.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.6 -55.98 27.14 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.912 1.285 . . . . 0.0 111.408 -178.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.9 m . . . . . 0 N--CA 1.453 -0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 111.763 -175.154 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -60.19 -52.13 66.61 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.865 0.866 . . . . 0.0 110.328 175.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -51.05 -50.11 59.25 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.507 1.123 . . . . 0.0 111.389 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 51.7 ttm-85 -55.2 -51.65 65.87 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.576 1.151 . . . . 0.0 110.698 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.95 -42.25 97.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.049 0.54 . . . . 0.0 111.733 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -59.75 -51.4 69.93 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.509 0.595 . . . . 0.0 110.14 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -55.76 -48.66 74.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.308 1.043 . . . . 0.0 111.031 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.99 -55.33 34.09 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.568 0.747 . . . . 0.0 110.221 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.84 -48.13 78.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.377 1.071 . . . . 0.0 111.77 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.77 -41.21 61.45 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.763 0.825 . . . . 0.0 110.926 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -103.22 54.7 0.76 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.114 0.966 . . . . 0.0 109.992 -177.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -129.43 81.88 69.01 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 123.833 0.853 . . . . 0.0 110.166 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.17 -37.25 38.54 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 125.04 3.826 . . . . 0.0 114.281 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -56.64 -35.0 67.86 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.194 0.998 . . . . 0.0 111.884 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.5 mt -89.57 138.41 31.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -88.83 -177.04 5.41 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -51.96 -47.68 64.69 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -61.51 -60.4 3.76 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.422 0.689 . . . . 0.0 110.615 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -58.21 -44.8 88.33 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.517 0.727 . . . . 0.0 111.14 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -62.31 -50.7 70.6 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.954 0.902 . . . . 0.0 110.397 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.4 -41.35 84.73 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.878 0.471 . . . . 0.0 110.956 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.05 89.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.809 0.444 . . . . 0.0 111.174 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -62.83 -50.59 70.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.917 0.887 . . . . 0.0 110.016 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 32.7 mm -53.96 -49.56 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 123.848 0.859 . . . . 0.0 109.875 175.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -56.54 -47.23 79.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.518 0.727 . . . . 0.0 110.954 179.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -58.11 -47.82 82.09 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.637 0.775 . . . . 0.0 111.446 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 51.6 mt -58.33 -48.41 85.08 Favored 'Isoleucine or valine' 0 C--N 1.341 0.234 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -63.91 -34.54 78.18 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.441 0.696 . . . . 0.0 112.126 -175.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -66.88 -51.39 56.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.461 0.705 . . . . 0.0 109.9 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.05 -47.38 74.88 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.599 1.16 . . . . 0.0 111.391 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.8 m . . . . . 0 N--CA 1.454 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.787 -175.772 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -61.68 -50.09 73.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.774 0.43 . . . . 0.0 111.292 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -36.07 80.1 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -62.75 -50.86 69.39 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.301 0.64 . . . . 0.0 109.618 176.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -58.57 -43.99 89.57 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.382 0.673 . . . . 0.0 111.242 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -55.38 -54.06 48.39 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 118.697 0.681 . . . . 0.0 110.283 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -54.03 -58.81 5.91 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.125 0.97 . . . . 0.0 111.384 -175.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.69 -40.03 95.84 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.23 99.1 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.216 0.607 . . . . 0.0 111.348 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -51.09 71.09 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -89.34 49.03 1.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.588 0.755 . . . . 0.0 110.494 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -117.88 98.95 52.01 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 124.417 1.087 . . . . 0.0 108.587 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.45 -23.97 14.53 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.09 2.526 . . . . 0.0 112.019 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -61.34 -37.01 81.74 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.899 0.879 . . . . 0.0 110.655 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.28 146.66 24.58 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.179 0.992 . . . . 0.0 108.761 177.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -89.32 -177.29 5.34 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -57.85 -46.07 85.34 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.065 0.946 . . . . 0.0 111.467 -176.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -57.94 -57.79 11.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.349 0.66 . . . . 0.0 110.276 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.47 -47.67 75.74 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.129 0.972 . . . . 0.0 110.929 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm105 -55.1 -57.57 11.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.768 1.227 . . . . 0.0 110.511 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -59.08 -39.37 81.95 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.943 0.497 . . . . 0.0 111.597 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.67 91.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.215 0.461 . . . . 0.0 111.244 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -65.23 -48.59 72.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.021 0.928 . . . . 0.0 109.87 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -55.68 -46.35 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.641 0.777 . . . . 0.0 110.143 175.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -58.13 -43.6 87.33 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.226 0.61 . . . . 0.0 111.021 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -60.4 -48.28 82.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.921 0.488 . . . . 0.0 111.192 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.74 -46.27 96.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 123.334 0.654 . . . . 0.0 110.179 178.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -62.75 -31.56 72.53 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.326 1.05 . . . . 0.0 111.509 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.23 -44.46 62.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.275 0.63 . . . . 0.0 109.925 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.81 -51.86 67.86 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.161 0.984 . . . . 0.0 110.661 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.19 0 C-N-CA 122.793 0.437 . . . . 0.0 110.803 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 . . . . . 0 CA--C 1.529 0.14 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.4 m -63.0 -44.0 97.23 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.857 0.463 . . . . 0.0 111.169 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.97 -55.97 19.53 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.36 1.064 . . . . 0.0 111.188 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -60.81 -45.35 94.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.872 0.869 . . . . 0.0 110.682 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -65.18 -37.12 86.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.765 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.36 -55.09 39.17 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.022 0.828 . . . . 0.0 109.659 174.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -52.26 -53.7 40.57 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.237 1.015 . . . . 0.0 110.517 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -54.25 -57.18 12.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.596 0.759 . . . . 0.0 110.804 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.1 -45.54 71.86 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.977 0.911 . . . . 0.0 111.912 -177.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.39 -47.13 63.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.828 1.251 . . . . 0.0 110.487 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -89.33 -19.81 24.82 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.599 0.76 . . . . 0.0 112.246 -173.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.74 117.85 24.18 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.421 1.089 . . . . 0.0 111.316 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -82.73 -24.66 3.33 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.557 2.838 . . . . 0.0 112.069 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -58.93 -38.72 79.62 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.474 1.11 . . . . 0.0 111.754 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -89.13 147.94 23.94 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -89.13 -179.74 5.96 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.628 0.771 . . . . 0.0 108.954 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.05 -48.64 61.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.516 0.726 . . . . 0.0 111.774 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -60.36 -58.63 7.7 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.91 0.884 . . . . 0.0 110.719 -175.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -66.32 -33.13 75.03 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.485 0.714 . . . . 0.0 111.834 -177.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -66.51 -48.7 68.94 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.844 0.857 . . . . 0.0 110.564 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.27 -39.49 94.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.153 0.433 . . . . 0.0 110.834 176.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.25 -42.98 96.47 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.72 0.408 . . . . 0.0 111.079 175.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.76 -50.95 71.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.084 0.954 . . . . 0.0 110.264 176.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.7 mm -52.28 -51.05 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.089 0.555 . . . . 0.0 110.003 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.7 -43.77 85.41 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.43 0.692 . . . . 0.0 111.527 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -59.13 -47.49 85.09 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.996 0.519 . . . . 0.0 110.751 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.6 mt -64.12 -42.55 95.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.422 0.689 . . . . 0.0 110.21 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -58.32 -39.31 79.07 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.004 0.521 . . . . 0.0 110.887 174.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.59 -41.39 72.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.552 0.741 . . . . 0.0 110.495 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -54.78 -57.07 13.02 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.455 1.102 . . . . 0.0 111.013 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 57.2 m . . . . . 0 C--N 1.34 0.168 0 CA-C-N 117.661 0.209 . . . . 0.0 111.043 179.26 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.0 m -62.35 -46.92 86.51 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.69 0.396 . . . . 0.0 109.95 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -60.49 -47.65 85.22 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 122.888 0.475 . . . . 0.0 111.413 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -55.21 -49.6 71.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.679 1.191 . . . . 0.0 110.616 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.21 -40.69 96.58 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.792 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -58.54 -52.74 64.38 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.909 0.777 . . . . 0.0 110.437 176.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -54.93 -52.4 63.07 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.54 1.136 . . . . 0.0 110.687 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.28 -55.82 27.08 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.54 0.736 . . . . 0.0 110.071 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.0 -46.43 71.74 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 111.561 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.02 -50.1 48.59 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.243 1.017 . . . . 0.0 109.966 177.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.01 3.08 54.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.935 0.894 . . . . 0.0 113.031 -175.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -73.21 122.06 86.69 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 119.008 0.822 . . . . 0.0 110.89 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -80.15 -28.47 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.256 2.637 . . . . 0.0 112.037 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -60.55 -47.07 87.82 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.185 0.994 . . . . 0.0 111.769 -171.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.9 mt -89.49 150.27 22.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.72 0.808 . . . . 0.0 109.541 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -89.46 -174.76 4.48 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.01 0.924 . . . . 0.0 109.274 175.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -51.39 -52.7 43.65 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.556 1.142 . . . . 0.0 111.911 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -65.69 -51.1 62.04 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.41 0.684 . . . . 0.0 111.054 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.75 -33.88 74.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.229 0.611 . . . . 0.0 111.251 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -61.2 -50.2 74.09 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.067 0.547 . . . . 0.0 109.794 172.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.43 -40.63 95.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.545 0.338 . . . . 0.0 111.006 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.14 -46.72 85.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.646 0.778 . . . . 0.0 110.856 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -59.07 -52.54 65.29 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.547 0.739 . . . . 0.0 110.113 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.0 mm -51.48 -58.17 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.84 0.856 . . . . 0.0 110.875 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.23 -35.7 81.69 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.7 p -63.89 -45.59 88.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.357 0.526 . . . . 0.0 110.668 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 39.8 mt -59.76 -48.04 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 119.013 -0.517 . . . . 0.0 109.635 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 41.3 mtm105 -57.89 -37.73 74.52 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.758 0.708 . . . . 0.0 111.934 177.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -67.05 -49.38 65.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.968 0.507 . . . . 0.0 109.868 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.27 -48.76 80.42 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.378 1.071 . . . . 0.0 111.131 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.3 m . . . . . 0 CA--C 1.53 0.184 0 C-N-CA 125.139 1.376 . . . . 0.0 111.813 -177.353 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 . . . . . 0 C--O 1.226 -0.148 0 N-CA-C 111.318 0.118 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.5 m -53.67 -37.95 63.68 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.741 1.216 . . . . 0.0 112.225 177.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -61.38 -45.21 95.31 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.77 -34.06 73.25 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.393 0.677 . . . . 0.0 110.785 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -63.29 -49.24 74.8 Favored 'General case' 0 C--N 1.341 0.224 0 C-N-CA 123.529 0.732 . . . . 0.0 110.135 173.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -59.14 -46.09 89.27 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.691 0.396 . . . . 0.0 111.151 176.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -57.31 -50.68 72.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.441 1.097 . . . . 0.0 110.681 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.91 -52.34 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.567 0.747 . . . . 0.0 110.686 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.67 -42.63 75.39 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.37 1.068 . . . . 0.0 111.597 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.55 -51.96 67.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.688 0.795 . . . . 0.0 110.005 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -91.57 62.98 4.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.777 0.831 . . . . 0.0 110.22 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -133.62 83.02 49.5 Favored Pre-proline 0 CA--C 1.536 0.44 0 C-N-CA 123.685 0.794 . . . . 0.0 109.47 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.38 -29.09 29.47 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 124.777 3.652 . . . . 0.0 114.798 -178.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -59.45 -29.68 67.97 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.794 0.838 . . . . 0.0 112.241 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.7 mt -89.51 165.1 14.5 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.338 0.655 . . . . 0.0 110.169 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.68 -165.58 1.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.215 1.006 . . . . 0.0 109.281 169.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -47.01 -75.81 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.293 1.437 . . . . 0.0 113.526 -170.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -60.51 -40.44 91.45 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -57.17 -52.83 63.75 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.943 0.897 . . . . 0.0 110.882 176.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.5 ttm-85 -61.06 -52.6 64.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.958 0.903 . . . . 0.0 110.313 -178.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -56.55 -42.56 78.76 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.908 0.483 . . . . 0.0 111.194 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.79 85.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.11 0.564 . . . . 0.0 111.436 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -62.12 -48.34 80.59 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.704 0.802 . . . . 0.0 109.841 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.88 -37.26 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.661 0.784 . . . . 0.0 110.297 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -61.73 -52.0 66.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.083 0.953 . . . . 0.0 110.327 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -59.15 -43.11 92.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.683 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.8 mt -60.58 -47.04 94.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 118.479 0.581 . . . . 0.0 109.931 176.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -55.13 -39.81 69.83 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 118.529 0.604 . . . . 0.0 111.904 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -67.64 -49.07 64.75 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 118.164 0.438 . . . . 0.0 110.14 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -60.36 -49.98 75.42 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.483 1.113 . . . . 0.0 111.248 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m . . . . . 0 N--CA 1.456 -0.155 0 C-N-CA 124.585 1.154 . . . . 0.0 111.472 -174.635 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 . . . . . 0 CA--C 1.532 0.266 0 CA-C-O 119.414 -0.326 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.12 -55.47 33.43 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.532 0.605 . . . . 0.0 109.787 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -60.9 -37.9 83.84 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.502 0.721 . . . . 0.0 111.904 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -61.06 -49.72 76.2 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.54 0.736 . . . . 0.0 109.987 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.56 -37.2 86.01 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.536 0.735 . . . . 0.0 111.523 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -58.85 -54.77 43.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.771 0.714 . . . . 0.0 110.248 174.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -55.86 -49.04 74.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.941 1.296 . . . . 0.0 111.066 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -55.69 -53.43 56.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.829 1.252 . . . . 0.0 110.802 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.61 87.43 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.339 1.056 . . . . 0.0 111.478 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.35 -48.18 74.62 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.491 0.717 . . . . 0.0 109.316 175.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -94.68 41.74 1.09 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.81 0.844 . . . . 0.0 111.17 -177.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -117.77 90.47 36.28 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.215 1.006 . . . . 0.0 108.523 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.74 -25.57 20.28 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.042 2.494 . . . . 0.0 112.01 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -60.3 -35.79 76.39 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.778 0.831 . . . . 0.0 110.972 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.2 mt -89.37 140.01 29.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -89.08 -175.4 4.8 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.405 0.682 . . . . 0.0 109.658 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -51.42 -50.0 60.53 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.938 0.895 . . . . 0.0 111.471 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.4 -54.37 37.77 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.209 0.604 . . . . 0.0 111.199 -174.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -59.76 -45.33 92.57 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.63 0.772 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -57.54 -56.53 20.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.003 0.921 . . . . 0.0 110.241 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.64 -42.38 88.15 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.581 . . . . 0.0 111.179 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.07 -48.16 82.59 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.973 0.509 . . . . 0.0 110.97 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.44 -50.49 73.52 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.927 0.891 . . . . 0.0 110.692 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.8 mm -51.74 -52.72 20.4 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.146 0.978 . . . . 0.0 110.025 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -56.57 -49.1 75.86 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.166 0.586 . . . . 0.0 111.468 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -54.26 -51.51 64.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.985 0.514 . . . . 0.0 111.219 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.6 mt -60.03 -45.52 95.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.226 0.611 . . . . 0.0 110.053 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -57.55 -39.61 77.03 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 123.22 0.608 . . . . 0.0 111.685 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -69.2 -46.16 68.14 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.752 0.421 . . . . 0.0 109.883 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -58.85 -49.89 76.04 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.285 1.034 . . . . 0.0 111.075 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.0 m . . . . . 0 CA--C 1.529 0.173 0 C-N-CA 124.572 1.149 . . . . 0.0 111.703 -176.541 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -46.12 -45.79 16.69 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.341 1.457 . . . . 0.0 111.473 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.42 -49.22 75.15 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.84 0.856 . . . . 0.0 111.622 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.94 -42.4 90.09 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.151 0.98 . . . . 0.0 109.604 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -60.85 -44.93 96.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.352 1.061 . . . . 0.0 110.983 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -60.39 -50.42 73.66 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.253 0.621 . . . . 0.0 110.344 176.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -54.84 -51.49 65.73 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.932 0.893 . . . . 0.0 110.805 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -56.0 -54.48 44.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.757 0.823 . . . . 0.0 110.41 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.06 -40.68 73.93 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.391 1.076 . . . . 0.0 111.831 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -52.18 66.78 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -89.8 51.47 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.956 0.902 . . . . 0.0 110.358 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -119.38 81.32 22.51 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.283 1.033 . . . . 0.0 109.458 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.2 -20.3 24.91 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.203 2.602 . . . . 0.0 111.886 177.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -60.86 -37.01 80.63 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.851 0.861 . . . . 0.0 110.866 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -89.28 159.3 17.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.493 0.717 . . . . 0.0 109.413 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 -89.54 175.08 7.43 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.763 0.825 . . . . 0.0 108.81 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.38 -33.2 72.12 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.86 -63.2 1.38 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.806 0.843 . . . . 0.0 110.898 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.42 -35.47 81.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.805 0.442 . . . . 0.0 110.885 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.2 ttp-105 -61.2 -52.55 64.32 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.071 0.549 . . . . 0.0 111.108 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -63.88 -38.35 90.77 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.731 0.696 . . . . 0.0 110.946 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -42.96 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.752 0.421 . . . . 0.0 110.821 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -61.07 -48.85 79.82 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.71 0.804 . . . . 0.0 110.387 177.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.1 -49.64 60.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 123.426 0.691 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -58.18 -42.67 86.59 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.739 0.816 . . . . 0.0 111.253 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -59.68 -48.63 80.91 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 122.865 0.466 . . . . 0.0 111.263 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.15 -46.93 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 118.268 0.485 . . . . 0.0 109.971 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -61.31 -33.81 74.21 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.593 0.757 . . . . 0.0 111.815 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -70.83 -44.94 65.44 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.172 0.589 . . . . 0.0 110.143 175.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -58.47 -52.6 64.95 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.423 1.089 . . . . 0.0 110.716 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 122.818 0.447 . . . . 0.0 110.834 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.446 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 13.1 pt20 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.5 m -68.93 -37.67 79.05 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 171.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -58.84 -42.63 89.74 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.835 0.454 . . . . 0.0 110.676 171.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 90.7 mtt-85 -63.25 -42.57 99.2 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.978 0.511 . . . . 0.0 110.416 177.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 9' ' ' GLN . 28.5 mmm180 -56.97 -51.12 70.49 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.052 0.541 . . . . 0.0 110.884 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -57.0 -52.62 64.56 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 122.571 0.348 . . . . 0.0 110.843 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -51.3 -59.73 3.9 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.349 1.06 . . . . 0.0 110.81 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -54.75 -48.42 72.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.759 0.824 . . . . 0.0 111.243 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.09 -45.95 86.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.748 0.819 . . . . 0.0 112.212 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.5 mt -59.77 -39.91 86.47 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.081 0.952 . . . . 0.0 111.942 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -89.2 -36.84 15.42 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.882 0.473 . . . . 0.0 111.543 -172.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.36 134.18 95.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.6 -126.48 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.945 2.43 . . . . 0.0 107.581 174.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 55.85 17.72 2.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.746 1.218 . . . . 0.0 113.289 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.3 mt -150.03 134.03 17.0 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.43 1.492 . . . . 0.0 107.64 -170.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.1 p30 -89.79 -176.36 4.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 169.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.79 -52.47 65.33 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.039 0.536 . . . . 0.0 111.195 -177.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -61.27 -53.33 58.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.289 0.636 . . . . 0.0 110.971 -174.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -62.39 -42.55 99.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.5 ttp85 -56.32 -61.46 2.39 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.013 0.525 . . . . 0.0 110.171 176.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -60.14 -35.87 76.24 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.251 -0.404 . . . . 0.0 111.986 -176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.69 -43.12 99.63 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.048 0.539 . . . . 0.0 111.295 175.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -69.64 -45.26 68.87 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 110.162 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.7 mm -54.47 -48.12 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.045 0.938 . . . . 0.0 110.017 172.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -58.14 -45.41 87.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.836 0.854 . . . . 0.0 110.911 177.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -57.68 -48.4 79.65 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.939 0.496 . . . . 0.0 111.057 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -57.96 -52.63 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.136 0.574 . . . . 0.0 109.64 176.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -57.28 -43.36 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.152 0.981 . . . . 0.0 112.065 -177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.04 -47.86 73.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.391 0.677 . . . . 0.0 110.319 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -51.97 67.61 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.024 0.93 . . . . 0.0 111.374 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 CA--C 1.529 0.168 0 C-N-CA 124.805 1.242 . . . . 0.0 111.282 -177.632 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 m -61.72 -35.3 77.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.585 0.629 . . . . 0.0 111.862 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -59.89 -55.27 36.23 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.388 0.54 . . . . 0.0 111.678 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.67 -30.62 71.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.427 0.558 . . . . 0.0 111.882 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -65.69 -43.11 90.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.205 0.602 . . . . 0.0 110.798 174.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -59.63 -50.86 72.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.916 0.78 . . . . 0.0 110.348 174.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -54.75 -49.8 69.96 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.291 1.037 . . . . 0.0 110.637 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -55.81 -54.03 49.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.895 0.878 . . . . 0.0 110.354 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.88 -47.0 71.51 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.19 0.996 . . . . 0.0 112.166 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.6 mt -53.59 -39.4 64.83 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.983 0.913 . . . . 0.0 112.182 177.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -98.92 -20.07 17.0 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.79 0.836 . . . . 0.0 113.166 -169.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.76 122.95 79.77 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.414 0.686 . . . . 0.0 110.493 -173.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.49 -29.31 11.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.479 2.786 . . . . 0.0 112.668 -173.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -63.53 -28.3 69.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.464 0.705 . . . . 0.0 111.203 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.4 mt -89.63 128.48 36.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -88.8 -165.97 1.48 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.16 -51.32 70.21 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.918 0.487 . . . . 0.0 111.001 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -58.24 -57.29 13.51 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.15 0.98 . . . . 0.0 110.598 -177.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -56.48 -41.98 77.49 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.148 1.379 . . . . 0.0 110.881 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.87 -55.22 28.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.346 0.658 . . . . 0.0 109.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -58.07 -41.21 82.9 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.819 0.736 . . . . 0.0 111.326 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.85 -44.4 94.14 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.802 0.441 . . . . 0.0 111.204 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.44 -50.43 72.83 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.14 0.976 . . . . 0.0 110.472 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.1 mm -52.69 -49.36 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.867 0.867 . . . . 0.0 110.084 175.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.5 -47.52 76.09 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.049 0.94 . . . . 0.0 110.94 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.5 m -60.76 -41.22 95.02 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.414 0.686 . . . . 0.0 112.027 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.5 mt -67.66 -49.62 68.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.496 -177.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -65.62 -36.48 83.85 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 118.202 0.455 . . . . 0.0 111.7 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.19 -46.22 90.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.086 0.555 . . . . 0.0 110.602 172.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -58.16 -57.22 13.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.455 1.102 . . . . 0.0 111.595 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.531 0.224 0 CA-C-N 117.914 0.325 . . . . 0.0 111.807 179.266 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.7 m -59.47 -43.86 93.16 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 124.082 0.953 . . . . 0.0 109.717 169.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -60.12 -43.79 95.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.125 0.57 . . . . 0.0 110.75 173.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -64.22 -37.6 88.07 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.187 0.595 . . . . 0.0 111.158 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -65.52 -46.38 79.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.119 0.968 . . . . 0.0 110.403 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.85 -54.79 42.94 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.285 0.493 . . . . 0.0 110.518 173.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -53.4 -48.4 68.72 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.777 1.631 . . . . 0.0 111.09 -177.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.09 -51.62 68.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.361 1.064 . . . . 0.0 110.782 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.98 -44.89 79.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.603 0.761 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -59.82 -52.71 64.28 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.823 0.849 . . . . 0.0 110.339 175.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -89.75 53.73 2.65 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.345 0.658 . . . . 0.0 110.501 -174.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -160.26 136.78 6.45 Favored Pre-proline 0 N--CA 1.453 -0.281 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -80.17 -129.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.845 2.363 . . . . 0.0 107.453 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 56.34 13.42 1.27 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.884 1.273 . . . . 0.0 113.429 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.5 mt -150.03 132.01 15.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.53 1.532 . . . . 0.0 107.392 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -89.8 -172.72 3.64 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -51.63 -52.56 46.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.374 0.669 . . . . 0.0 110.775 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -59.14 -56.83 17.1 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.701 0.8 . . . . 0.0 110.91 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -60.89 -40.46 93.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.898 0.879 . . . . 0.0 111.376 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.28 -57.3 13.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.569 0.748 . . . . 0.0 110.259 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -62.36 -35.7 79.95 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.256 -178.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.97 -43.76 98.16 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.049 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.22 -50.69 72.07 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.596 0.758 . . . . 0.0 110.299 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.17 -47.84 76.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 122.831 0.452 . . . . 0.0 110.106 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.9 tttp -58.42 -44.34 89.03 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.346 0.658 . . . . 0.0 111.247 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.4 m -61.68 -48.31 81.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.586 0.754 . . . . 0.0 111.084 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 49.8 mt -60.64 -47.63 92.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 123.587 0.755 . . . . 0.0 109.834 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 51.4 ttm-85 -64.21 -39.83 94.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.218 1.007 . . . . 0.0 111.674 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -65.0 -50.44 66.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.776 0.83 . . . . 0.0 110.355 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.76 -52.95 62.18 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.796 1.238 . . . . 0.0 111.216 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.455 -0.177 0 C-N-CA 124.123 0.969 . . . . 0.0 111.733 -177.669 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 119.623 -0.227 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.53 -45.56 86.66 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.93 0.492 . . . . 0.0 110.58 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -54.87 -54.46 42.18 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.689 0.796 . . . . 0.0 110.643 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.0 -42.71 80.79 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.88 1.272 . . . . 0.0 110.834 177.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.3 -51.32 70.43 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.135 0.974 . . . . 0.0 111.708 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -58.63 -52.47 65.55 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 118.068 0.395 . . . . 0.0 110.407 177.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -54.66 -51.3 65.9 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.186 0.994 . . . . 0.0 111.42 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.98 -53.38 59.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.618 1.167 . . . . 0.0 110.764 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -39.19 90.97 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.88 0.872 . . . . 0.0 112.117 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 mt -57.83 -52.0 67.29 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.042 0.537 . . . . 0.0 109.721 173.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.32 0.648 . . . . 0.0 110.139 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -126.03 92.86 45.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.689 1.195 . . . . 0.0 108.509 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -72.81 -28.21 13.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.051 2.5 . . . . 0.0 111.92 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -60.59 -33.01 72.09 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.974 0.91 . . . . 0.0 111.2 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.13 137.18 32.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -88.77 172.72 9.02 Favored 'General case' 0 C--N 1.338 0.085 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -50.92 -41.16 58.53 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.323 0.649 . . . . 0.0 112.524 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.36 -62.38 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.188 0.595 . . . . 0.0 110.93 -176.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -64.65 -37.57 88.01 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.233 0.613 . . . . 0.0 111.012 -176.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -59.83 -54.67 43.55 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.959 0.904 . . . . 0.0 110.619 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.99 -40.53 95.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.163 0.438 . . . . 0.0 110.94 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.06 91.02 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.048 0.539 . . . . 0.0 110.916 175.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -50.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.809 0.444 . . . . 0.0 110.237 178.126 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.2 mm -53.24 -46.25 56.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.177 0.991 . . . . 0.0 110.127 178.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.69 -46.99 87.4 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.586 0.754 . . . . 0.0 111.016 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.2 t -61.92 -47.96 82.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.437 0.695 . . . . 0.0 111.282 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.75 -45.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 124.329 1.052 . . . . 0.0 109.125 177.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -64.08 -40.86 97.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.896 0.878 . . . . 0.0 111.598 -178.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.96 -48.6 81.04 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.264 0.626 . . . . 0.0 110.417 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.07 -51.62 67.2 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.786 0.834 . . . . 0.0 111.514 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 93.7 m . . . . . 0 CA--C 1.531 0.212 0 C-N-CA 125.185 1.394 . . . . 0.0 112.157 -175.331 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -57.73 -43.48 85.33 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.02 0.928 . . . . 0.0 111.29 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -56.92 -50.97 70.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.718 0.807 . . . . 0.0 110.674 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -63.35 -38.64 91.94 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.749 0.82 . . . . 0.0 111.659 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.7 mtp180 -62.03 -48.27 81.01 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.902 0.881 . . . . 0.0 110.458 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.88 -49.94 75.02 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.111 0.564 . . . . 0.0 111.031 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -57.64 -49.44 76.46 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.128 0.971 . . . . 0.0 110.883 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -55.92 -56.36 21.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.949 0.9 . . . . 0.0 110.15 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -40.65 76.86 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.186 0.994 . . . . 0.0 111.873 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 tp -60.09 -49.48 77.46 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.658 0.783 . . . . 0.0 109.812 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -93.39 58.44 2.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.75 0.82 . . . . 0.0 109.928 -178.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -129.11 86.89 55.78 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.803 0.841 . . . . 0.0 110.564 -178.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.57 -26.36 78.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 124.036 3.157 . . . . 0.0 113.318 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -55.39 -45.12 76.64 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.963 1.305 . . . . 0.0 111.855 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.0 mt -89.28 163.64 15.28 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.575 0.75 . . . . 0.0 109.644 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -89.41 -175.53 4.76 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.573 0.749 . . . . 0.0 109.37 174.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.3 -54.87 30.3 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 111.029 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -56.28 -52.86 62.95 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.567 0.747 . . . . 0.0 110.634 -179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 72.6 mm-40 -60.65 -41.32 94.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 111.981 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ttp-105 -64.44 -46.97 80.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.084 0.554 . . . . 0.0 110.873 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -61.52 -39.08 89.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.106 0.412 . . . . 0.0 110.88 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.87 -44.05 97.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.957 0.503 . . . . 0.0 110.859 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -58.93 -50.59 73.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 0.0 110.507 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.0 mm -53.73 -47.75 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.704 0.802 . . . . 0.0 110.17 175.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.08 -45.2 93.69 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.568 0.747 . . . . 0.0 111.328 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -60.75 -45.57 93.78 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.645 0.778 . . . . 0.0 111.197 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.63 -47.33 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 123.426 0.691 . . . . 0.0 109.638 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -62.26 -43.29 99.16 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.613 0.765 . . . . 0.0 111.853 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.8 -50.82 70.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.842 0.857 . . . . 0.0 110.571 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.82 -53.51 57.41 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.643 1.177 . . . . 0.0 111.282 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.6 m . . . . . 0 CA--C 1.531 0.233 0 C-N-CA 124.33 1.052 . . . . 0.0 112.293 -175.27 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 . . . . . 0 CA--C 1.53 0.21 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.84 -36.36 78.08 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.666 0.787 . . . . 0.0 111.732 -178.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.9 tm0? -56.0 -53.02 61.93 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.415 0.686 . . . . 0.0 109.995 170.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -59.16 -41.76 89.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.165 0.986 . . . . 0.0 111.395 179.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -61.48 -49.39 76.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.364 0.666 . . . . 0.0 111.009 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -56.23 -56.08 25.42 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.232 0.469 . . . . 0.0 110.391 176.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -53.33 -52.77 58.1 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.209 1.404 . . . . 0.0 110.917 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -54.73 -55.76 26.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.165 0.986 . . . . 0.0 110.292 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.81 -44.28 70.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.708 0.803 . . . . 0.0 111.853 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.56 -46.85 63.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.069 1.348 . . . . 0.0 110.679 178.429 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -89.73 -30.8 17.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.669 0.788 . . . . 0.0 112.782 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -57.01 110.79 2.66 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 111.926 -169.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.15 -22.44 22.47 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.055 2.503 . . . . 0.0 112.126 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -61.3 -27.61 68.6 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.19 0.596 . . . . 0.0 111.011 175.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -89.61 132.36 35.15 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 172.064 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.4 p30 -89.18 -174.18 4.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 171.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.56 -44.02 68.93 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.54 0.736 . . . . 0.0 112.672 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.57 -59.83 3.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.365 1.066 . . . . 0.0 109.954 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -52.87 -46.68 68.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.927 1.291 . . . . 0.0 110.63 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 ttp-105 -61.97 -57.13 12.88 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.329 1.052 . . . . 0.0 111.327 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -61.22 -41.38 96.76 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.277 0.944 . . . . 0.0 111.077 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.71 -46.56 81.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.419 0.688 . . . . 0.0 111.016 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.69 -48.48 81.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.094 0.958 . . . . 0.0 110.91 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.7 mm -55.06 -49.43 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 122.901 0.481 . . . . 0.0 110.0 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -59.85 -40.95 90.31 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.929 0.492 . . . . 0.0 111.87 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -60.74 -46.91 88.63 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.92 0.488 . . . . 0.0 110.821 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 33.1 mt -64.94 -41.19 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.642 0.777 . . . . 0.0 109.766 178.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -57.12 -48.3 79.0 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.15 0.98 . . . . 0.0 110.565 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -63.76 -57.45 9.92 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.528 0.731 . . . . 0.0 110.635 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -50.25 -56.06 12.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.482 1.513 . . . . 0.0 111.977 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.664 1.185 . . . . 0.0 113.069 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.8 m -58.21 -45.02 88.39 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.032 0.533 . . . . 0.0 110.411 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -58.53 -48.49 80.67 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.665 0.786 . . . . 0.0 111.412 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -55.81 -48.51 75.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.263 1.025 . . . . 0.0 110.57 175.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.2 mtp180 -60.35 -47.15 87.3 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.178 0.591 . . . . 0.0 111.244 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -57.52 -51.14 70.67 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.495 0.718 . . . . 0.0 110.552 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -54.78 -58.96 5.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.386 1.074 . . . . 0.0 110.619 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -53.99 -51.11 64.98 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.53 0.732 . . . . 0.0 111.048 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.76 -49.1 76.27 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.618 0.767 . . . . 0.0 111.509 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.9 -43.14 65.96 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.67 1.188 . . . . 0.0 111.743 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -89.71 -22.64 22.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.441 0.696 . . . . 0.0 112.602 -174.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.95 114.64 6.74 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.241 1.016 . . . . 0.0 111.097 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -76.81 -28.42 6.33 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.094 2.529 . . . . 0.0 111.934 -177.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -56.09 -42.26 76.47 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 124.821 1.249 . . . . 0.0 112.126 -173.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.3 mt -89.26 139.4 30.53 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -88.77 -177.69 5.59 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.023 0.929 . . . . 0.0 108.916 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -46.99 -51.95 15.91 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.793 0.837 . . . . 0.0 112.056 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -63.14 -56.47 16.5 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.564 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -66.86 -43.29 83.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.287 0.635 . . . . 0.0 110.942 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -60.92 -49.46 77.37 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.832 0.853 . . . . 0.0 110.298 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -63.42 -41.67 98.7 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.804 0.842 . . . . 0.0 110.258 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.85 -38.3 75.42 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.569 0.347 . . . . 0.0 111.178 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -62.36 -46.98 86.23 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 110.065 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.7 mm -55.55 -48.23 77.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.084 0.554 . . . . 0.0 110.151 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -57.37 -42.07 81.38 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.75 0.42 . . . . 0.0 111.383 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 m -62.19 -44.08 97.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.235 0.614 . . . . 0.0 111.465 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.66 -45.82 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -60.99 -38.17 85.03 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.671 0.788 . . . . 0.0 111.645 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -66.01 -47.63 73.84 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.453 0.701 . . . . 0.0 110.381 174.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -58.08 -54.6 45.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.4 1.08 . . . . 0.0 111.307 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.207 0 C-N-CA 123.149 0.58 . . . . 0.0 111.553 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 110.591 -0.152 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.7 -51.74 67.61 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.77 0.428 . . . . 0.0 111.442 174.323 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -50.84 -55.9 14.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.597 1.159 . . . . 0.0 110.82 -178.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -55.82 -53.9 51.08 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.57 0.748 . . . . 0.0 111.091 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -59.9 -45.5 92.36 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.888 -176.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.1 -56.85 16.41 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.135 0.574 . . . . 0.0 110.281 176.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -49.63 -56.75 8.93 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -55.51 -51.11 68.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.998 0.919 . . . . 0.0 110.919 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.48 87.69 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.619 0.768 . . . . 0.0 112.227 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.5 mt -58.33 -44.67 88.78 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.009 0.924 . . . . 0.0 111.837 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -89.35 -43.61 10.79 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.874 0.47 . . . . 0.0 111.749 -170.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.84 136.27 90.15 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 109.744 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.54 -127.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.864 2.376 . . . . 0.0 107.717 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 54.72 15.62 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.787 1.235 . . . . 0.0 113.49 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.5 mt -150.0 133.18 16.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.431 1.493 . . . . 0.0 107.635 -170.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -89.41 170.79 10.23 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 170.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -48.43 -57.41 6.12 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.282 1.033 . . . . 0.0 112.302 -173.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -57.45 -48.61 78.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.576 0.75 . . . . 0.0 111.35 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -68.54 -35.08 76.94 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.678 0.791 . . . . 0.0 111.533 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -67.33 -48.27 68.04 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.162 0.437 . . . . 0.0 109.859 177.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -59.42 -39.87 84.9 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.615 0.366 . . . . 0.0 111.019 174.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.05 -39.97 94.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.972 0.509 . . . . 0.0 111.303 176.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.5 -50.74 71.49 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.449 0.7 . . . . 0.0 110.196 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.8 mm -55.01 -48.64 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 122.99 0.516 . . . . 0.0 110.388 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -58.71 -45.45 89.51 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.014 0.526 . . . . 0.0 111.197 178.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.5 t -59.24 -46.74 87.68 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.629 0.771 . . . . 0.0 111.023 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -49.3 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 123.983 0.913 . . . . 0.0 109.945 177.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -57.19 -39.45 75.41 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.876 1.271 . . . . 0.0 111.953 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.67 -45.82 67.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.118 0.567 . . . . 0.0 110.344 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.89 -51.46 67.5 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.56 1.144 . . . . 0.0 111.054 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.5 m . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 123.338 0.655 . . . . 0.0 110.39 178.069 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.426 0.155 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 m -64.74 -49.11 72.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.349 0.66 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -61.13 -44.55 97.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.914 0.486 . . . . 0.0 111.217 179.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -55.17 -51.01 67.85 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.806 1.242 . . . . 0.0 110.56 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -66.46 -38.97 88.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.718 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -58.19 -56.61 19.88 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.848 0.749 . . . . 0.0 110.01 174.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -51.81 -50.74 60.23 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.34 1.456 . . . . 0.0 110.743 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -55.96 -55.17 35.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.739 0.816 . . . . 0.0 110.665 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.23 -39.62 75.91 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.988 0.915 . . . . 0.0 112.121 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.43 -47.71 78.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.79 1.236 . . . . 0.0 110.489 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -89.36 -30.59 18.29 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.484 0.714 . . . . 0.0 111.912 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.11 123.9 67.29 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 124.648 1.179 . . . . 0.0 109.684 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -79.96 -135.98 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.961 2.441 . . . . 0.0 106.151 170.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.6 m120 70.18 -52.24 0.64 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.183 1.793 . . . . 0.0 112.407 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -88.88 151.7 22.18 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 126.269 1.828 . . . . 0.0 108.552 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -89.47 -174.64 4.43 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 172.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -58.18 -46.46 85.71 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.795 0.838 . . . . 0.0 111.717 -175.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -64.57 -48.86 73.43 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.879 -176.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -67.5 -35.09 78.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.166 0.586 . . . . 0.0 111.51 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -61.06 -51.4 69.32 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 172.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -59.94 -37.06 78.41 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.992 0.517 . . . . 0.0 111.122 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.29 97.84 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.402 0.681 . . . . 0.0 110.948 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -59.57 -52.09 67.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.466 0.707 . . . . 0.0 110.253 176.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.6 mm -52.96 -51.09 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.109 0.564 . . . . 0.0 109.98 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -57.33 -46.07 83.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.535 1.134 . . . . 0.0 111.656 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 p -64.41 -38.14 89.98 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.136 0.426 . . . . 0.0 111.672 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.69 -45.34 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.16 -40.91 82.62 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.557 0.743 . . . . 0.0 111.097 176.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.87 -51.18 63.39 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.515 0.726 . . . . 0.0 110.582 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.69 -50.32 66.12 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.076 1.351 . . . . 0.0 111.272 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.1 m . . . . . 0 N--CA 1.454 -0.248 0 C-N-CA 124.433 1.093 . . . . 0.0 111.777 -176.183 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 58.6 m -59.6 -55.57 32.82 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.372 1.069 . . . . 0.0 110.686 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -67.88 -34.55 76.89 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -61.09 -47.86 84.35 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.929 0.492 . . . . 0.0 109.865 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.34 -41.49 96.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 118.495 -0.765 . . . . 0.0 111.393 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.18 -52.02 64.67 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.083 0.856 . . . . 0.0 110.341 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -55.46 -57.45 11.85 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.613 1.165 . . . . 0.0 110.696 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -54.18 -51.55 64.0 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.175 0.59 . . . . 0.0 111.102 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.55 -46.87 85.94 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.692 0.797 . . . . 0.0 111.649 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.27 -43.49 67.49 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.747 1.219 . . . . 0.0 111.47 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -89.54 -19.24 25.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.18 0.592 . . . . 0.0 112.31 -175.339 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.33 120.01 44.32 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 123.535 0.734 . . . . 0.0 110.783 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -81.17 -28.96 2.17 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.444 2.763 . . . . 0.0 111.955 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -55.89 -40.98 73.77 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.697 -174.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.0 mt -89.17 130.55 35.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 172.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -89.0 -178.82 5.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 178.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -41.4 -63.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.193 1.397 . . . . 0.0 113.528 -171.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.11 -44.65 91.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -64.85 -44.87 88.38 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.785 0.834 . . . . 0.0 110.645 -178.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -63.21 -47.61 81.8 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.483 1.513 . . . . 0.0 110.378 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -59.65 -42.34 92.55 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.382 0.673 . . . . 0.0 110.674 176.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.5 -38.05 85.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.623 0.369 . . . . 0.0 111.084 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -62.1 -49.98 73.77 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.673 0.789 . . . . 0.0 109.988 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 34.4 mm -53.62 -47.43 61.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.833 0.853 . . . . 0.0 110.221 174.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -56.93 -46.27 82.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.874 0.87 . . . . 0.0 110.927 178.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.0 m -60.81 -41.3 95.43 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.626 0.77 . . . . 0.0 111.779 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 46.8 mt -63.23 -52.11 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 118.15 0.432 . . . . 0.0 110.284 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -67.99 -33.79 75.3 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.12 -51.63 68.77 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.361 0.664 . . . . 0.0 110.496 172.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -56.98 -51.28 69.83 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.961 1.304 . . . . 0.0 111.094 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.6 m . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.369 1.067 . . . . 0.0 111.769 -178.349 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 . . . . . 0 CA--C 1.532 0.271 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.2 m -54.9 -54.3 44.39 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.636 0.774 . . . . 0.0 109.165 170.018 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -53.4 -41.46 65.99 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.371 1.068 . . . . 0.0 111.593 177.281 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -64.34 -49.1 73.03 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 122.674 0.39 . . . . 0.0 110.762 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -57.88 -47.08 83.79 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.037 177.997 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -55.7 -57.87 10.19 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.946 0.498 . . . . 0.0 110.91 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -50.37 -58.79 4.9 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.425 1.49 . . . . 0.0 111.19 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.75 -51.28 69.47 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.548 0.739 . . . . 0.0 110.899 -178.798 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.39 -41.54 72.8 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.401 0.68 . . . . 0.0 112.002 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -57.26 -48.26 79.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.273 1.029 . . . . 0.0 110.46 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -89.09 -23.88 22.41 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -169.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.59 123.24 70.04 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 118.525 0.602 . . . . 0.0 111.002 -172.628 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.13 -30.89 6.5 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.436 2.757 . . . . 0.0 112.37 -174.775 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -63.09 -27.51 69.44 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.603 0.761 . . . . 0.0 111.345 -179.487 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 mp -88.94 125.68 35.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.581 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p-10 -88.9 -172.13 3.57 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.593 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.16 -42.22 65.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.997 0.519 . . . . 0.0 112.01 178.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.03 -60.85 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.675 0.79 . . . . 0.0 110.886 -176.821 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -60.32 -39.72 88.01 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.38 0.672 . . . . 0.0 110.536 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 ttp85 -58.69 -61.13 2.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.754 0.822 . . . . 0.0 110.263 177.802 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -61.01 -38.5 86.29 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 119.123 0.874 . . . . 0.0 111.439 -174.693 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -43.78 92.52 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.677 0.791 . . . . 0.0 111.347 174.607 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -49.23 69.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.495 0.718 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 31.0 mm -56.02 -40.81 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.95 0.9 . . . . 0.0 109.996 176.471 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -62.32 -48.33 80.32 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.517 0.727 . . . . 0.0 110.852 175.851 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 m -56.53 -48.74 76.61 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.089 0.556 . . . . 0.0 111.005 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.0 mt -64.67 -39.94 87.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.01 0.524 . . . . 0.0 109.982 -178.842 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -57.16 -41.3 78.92 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.962 0.801 . . . . 0.0 111.538 172.217 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -67.78 -43.77 78.99 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.078 0.399 . . . . 0.0 110.11 -178.896 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.4 -58.05 7.57 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.557 1.143 . . . . 0.0 111.237 -179.286 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.7 m . . . . . 0 CA--C 1.53 0.175 0 C-N-CA 124.729 1.212 . . . . 0.0 111.599 -173.29 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 . . . . . 0 CA--C 1.53 0.207 0 N-CA-C 110.653 -0.128 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.39 -42.44 96.13 Favored 'General case' 0 C--N 1.338 0.08 0 C-N-CA 123.438 0.695 . . . . 0.0 110.666 177.936 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -57.78 -48.54 79.38 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.685 0.794 . . . . 0.0 110.569 175.778 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -58.41 -46.41 86.49 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.023 0.929 . . . . 0.0 111.251 176.208 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 -59.77 -47.76 84.38 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.46 0.704 . . . . 0.0 111.119 179.357 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -58.03 -56.51 21.13 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 122.916 0.486 . . . . 0.0 110.468 176.596 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -50.44 -51.58 45.41 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.58 1.152 . . . . 0.0 110.9 -179.312 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -56.39 -57.95 10.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.782 0.833 . . . . 0.0 110.514 178.013 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.92 -44.65 74.43 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.093 0.957 . . . . 0.0 112.381 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.5 mt -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.066 0.947 . . . . 0.0 111.583 178.666 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -89.67 -23.15 21.94 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.242 0.617 . . . . 0.0 112.284 -172.008 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -60.79 126.4 85.3 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 124.194 0.997 . . . . 0.0 109.828 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.16 -129.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.1 2.533 . . . . 0.0 106.428 170.799 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.1 m120 70.42 -55.76 0.61 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.45 1.9 . . . . 0.0 113.472 175.361 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.3 mt -88.85 166.42 14.0 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.104 1.762 . . . . 0.0 109.193 -177.016 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -89.6 -177.8 5.39 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.039 0.536 . . . . 0.0 109.566 171.448 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -60.56 -55.32 34.82 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.072 0.949 . . . . 0.0 110.853 -175.554 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -58.8 -49.05 79.14 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.942 0.897 . . . . 0.0 111.34 -176.65 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.88 -46.12 90.33 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.984 0.514 . . . . 0.0 111.232 178.526 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.8 ttp-105 -64.31 -50.69 66.83 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.955 0.502 . . . . 0.0 111.645 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -63.93 -39.05 93.26 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 118.708 0.685 . . . . 0.0 111.57 179.325 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.62 -38.16 69.13 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.976 0.51 . . . . 0.0 110.987 171.728 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.12 -45.62 92.68 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.468 0.707 . . . . 0.0 110.366 174.904 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.6 mm -56.64 -48.53 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 122.966 0.506 . . . . 0.0 110.221 175.727 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -56.62 -46.18 81.08 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.001 0.52 . . . . 0.0 110.876 176.616 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -58.06 -47.62 82.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.57 0.748 . . . . 0.0 111.623 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -58.54 -49.44 82.34 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 176.84 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -61.82 -41.23 97.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.672 0.789 . . . . 0.0 111.984 -176.419 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -63.89 -52.1 61.49 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.079 0.952 . . . . 0.0 110.396 176.779 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.86 -51.96 65.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.638 1.175 . . . . 0.0 111.443 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 97.8 m . . . . . 0 CA--C 1.53 0.182 0 C-N-CA 124.654 1.181 . . . . 0.0 112.234 -175.365 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 93.1 m -60.57 -38.55 84.93 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.246 1.018 . . . . 0.0 112.37 -170.212 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -51.39 -52.74 43.23 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.612 0.765 . . . . 0.0 110.221 173.7 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -67.58 -36.44 80.91 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.785 0.834 . . . . 0.0 111.443 -177.784 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -60.44 -52.85 63.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 175.507 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -57.98 -52.38 65.77 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.224 0.609 . . . . 0.0 110.973 178.516 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -55.24 -51.61 66.03 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.882 1.273 . . . . 0.0 111.074 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -57.35 -51.69 68.36 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.959 0.904 . . . . 0.0 110.642 178.014 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.52 -39.52 76.73 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.87 0.868 . . . . 0.0 111.89 179.668 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.21 70.55 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 175.618 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.561 0.744 . . . . 0.0 110.139 -176.472 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -129.84 77.07 77.44 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.366 1.067 . . . . 0.0 109.051 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -70.05 -14.78 35.59 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.441 2.761 . . . . 0.0 112.463 -179.395 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -59.46 -36.26 75.63 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 110.047 173.08 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.34 146.31 24.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.243 1.017 . . . . 0.0 108.279 172.659 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -88.65 179.93 6.16 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -47.77 -51.32 22.82 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.853 1.261 . . . . 0.0 111.754 -178.963 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.02 -59.28 5.68 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.361 1.064 . . . . 0.0 111.16 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -55.06 -43.19 73.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.36 1.064 . . . . 0.0 111.29 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.8 ttp180 -64.82 -50.62 65.98 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 111.101 -177.814 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -63.49 -40.14 96.3 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.977 0.808 . . . . 0.0 111.352 178.201 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.59 88.55 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.443 0.697 . . . . 0.0 110.942 175.711 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -63.02 -47.86 81.22 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.894 0.877 . . . . 0.0 110.588 177.387 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.1 mm -54.47 -47.46 70.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.146 0.578 . . . . 0.0 110.525 175.55 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -61.51 -43.51 98.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.568 0.747 . . . . 0.0 111.363 178.724 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.6 m -60.31 -49.24 78.37 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.214 0.606 . . . . 0.0 110.684 178.232 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.1 mt -57.04 -44.77 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 123.626 0.771 . . . . 0.0 109.38 175.933 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -64.0 -34.72 78.64 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.309 0.644 . . . . 0.0 111.953 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -68.41 -47.86 66.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.142 0.577 . . . . 0.0 109.855 176.602 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -59.1 -49.81 76.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.235 1.014 . . . . 0.0 111.146 178.989 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.455 -0.212 0 C-N-CA 125.279 1.432 . . . . 0.0 111.407 -175.138 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 119.772 -0.156 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 90.8 m -63.48 -44.28 94.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.032 0.533 . . . . 0.0 110.762 176.147 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -58.26 -49.8 75.83 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.879 0.472 . . . . 0.0 110.882 177.004 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -54.19 -51.82 63.16 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.336 1.055 . . . . 0.0 110.506 175.265 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -52.79 -48.89 66.54 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.914 1.285 . . . . 0.0 111.391 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -60.9 -53.21 60.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.519 0.328 . . . . 0.0 111.178 176.588 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -54.13 -58.84 5.83 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.994 0.918 . . . . 0.0 111.077 -176.407 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.41 -45.16 94.6 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.567 -176.813 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.99 92.05 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.266 0.484 . . . . 0.0 111.455 179.133 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.25 -46.18 79.73 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.743 1.217 . . . . 0.0 111.473 -178.094 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -89.2 -28.56 19.89 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.059 0.544 . . . . 0.0 111.808 -171.942 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.88 122.07 59.45 Favored Pre-proline 0 CA--C 1.532 0.277 0 C-N-CA 123.674 0.79 . . . . 0.0 110.175 177.095 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -80.94 -132.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.106 2.537 . . . . 0.0 106.106 169.862 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 70.55 -50.95 0.67 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.431 1.892 . . . . 0.0 113.073 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.1 mt -88.77 162.04 16.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.883 1.673 . . . . 0.0 108.554 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -90.07 178.64 6.14 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.928 0.394 . . . . 0.0 110.579 175.37 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.05 -41.09 82.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.925 0.89 . . . . 0.0 111.394 179.464 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.16 -58.06 10.32 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.35 0.66 . . . . 0.0 110.573 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -55.56 -49.94 71.36 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.828 1.251 . . . . 0.0 110.897 179.132 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 ttp-105 -67.42 -42.41 83.24 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.439 0.695 . . . . 0.0 112.137 -173.611 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -70.88 -39.18 72.98 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.937 0.789 . . . . 0.0 110.543 178.48 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.2 -40.26 89.47 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.631 0.773 . . . . 0.0 111.298 175.385 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -58.97 -51.98 67.73 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.67 0.788 . . . . 0.0 109.758 174.223 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mt -57.5 -40.74 76.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 118.202 0.455 . . . . 0.0 111.52 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -61.02 -42.98 99.5 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 176.914 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.6 m -64.02 -44.36 92.81 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.632 0.773 . . . . 0.0 111.014 178.24 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.6 mt -62.15 -49.23 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.2 mtp-105 -52.66 -50.1 63.9 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.97 0.908 . . . . 0.0 111.327 175.465 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -58.97 -50.51 73.79 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.525 0.73 . . . . 0.0 111.023 -178.703 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.64 -52.21 65.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.37 1.068 . . . . 0.0 111.508 -179.19 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 88.1 m . . . . . 0 N--CA 1.455 -0.191 0 C-N-CA 125.238 1.415 . . . . 0.0 112.264 -173.786 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 111.336 0.124 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -159.85 -165.39 1.5 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.793 1.237 . . . . 0.0 109.464 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.7 mtt -52.18 -43.8 64.35 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.857 1.263 . . . . 0.0 112.305 -178.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -62.2 -42.79 99.61 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 117.993 0.361 . . . . 0.0 110.686 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.9 m -66.24 -45.0 82.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.077 0.951 . . . . 0.0 110.041 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -54.85 -53.83 50.22 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.08 0.952 . . . . 0.0 110.52 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -60.62 -43.55 97.35 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.689 0.796 . . . . 0.0 111.389 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.4 mtp85 -60.6 -45.48 93.84 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.466 0.706 . . . . 0.0 111.206 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -59.19 -52.58 65.07 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.278 0.49 . . . . 0.0 110.296 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -53.85 -48.74 69.68 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.17 0.988 . . . . 0.0 111.096 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -59.15 -53.28 60.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.645 0.778 . . . . 0.0 110.786 176.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.25 77.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.252 1.021 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.42 -53.84 52.69 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.411 0.685 . . . . 0.0 109.708 173.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -89.99 59.72 4.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.612 0.765 . . . . 0.0 110.136 -174.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -133.21 81.33 56.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.698 0.799 . . . . 0.0 110.226 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -54.78 -29.03 60.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 124.541 3.494 . . . . 0.0 114.125 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -58.72 -32.74 69.47 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.86 0.864 . . . . 0.0 111.594 -178.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.6 mt -89.47 153.34 20.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.65 0.78 . . . . 0.0 109.393 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -89.53 -177.65 5.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.35 -51.43 69.44 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.541 0.736 . . . . 0.0 111.431 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -61.04 -51.95 67.02 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.899 0.88 . . . . 0.0 110.383 -174.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.87 -50.85 69.5 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.692 1.197 . . . . 0.0 110.883 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -59.24 -51.4 70.13 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.896 0.878 . . . . 0.0 111.06 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -59.13 -40.09 84.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.093 0.557 . . . . 0.0 111.362 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.654 0.382 . . . . 0.0 111.086 174.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -62.89 -50.7 69.86 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 109.96 178.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.2 mm -53.92 -48.81 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.277 1.031 . . . . 0.0 109.978 175.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -58.0 -43.41 86.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.871 0.869 . . . . 0.0 111.093 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -61.89 -47.18 86.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.36 0.664 . . . . 0.0 111.286 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.2 mt -57.41 -50.76 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -62.1 -43.24 99.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.875 0.87 . . . . 0.0 111.723 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.14 -51.45 69.01 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.919 0.888 . . . . 0.0 110.604 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.99 -52.78 64.31 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.316 1.046 . . . . 0.0 111.392 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.2 m -73.33 -28.85 62.29 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.6 1.16 . . . . 0.0 112.347 -175.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.039 0 CA-C-N 118.131 0.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -74.68 171.61 13.6 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.604 0.761 . . . . 0.0 111.201 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.9 ptp -78.46 54.01 1.38 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.58 1.152 . . . . 0.0 111.358 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 tm0? -155.35 -57.65 0.1 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 125.925 1.69 . . . . 0.0 106.795 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.8 m -59.54 -44.64 93.16 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.803 0.841 . . . . 0.0 109.57 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -49.92 -51.85 37.75 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.521 1.128 . . . . 0.0 111.265 173.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -65.03 -40.25 94.57 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.48 0.712 . . . . 0.0 110.893 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -61.4 -48.29 81.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.252 0.621 . . . . 0.0 110.881 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -57.13 -50.14 73.72 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.229 0.612 . . . . 0.0 110.744 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -57.12 -52.36 65.6 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.08 0.952 . . . . 0.0 110.882 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -55.68 -54.03 49.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.683 0.793 . . . . 0.0 110.751 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.6 -47.63 76.2 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.053 0.941 . . . . 0.0 111.354 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 tp -55.39 -39.25 69.92 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.538 1.135 . . . . 0.0 111.382 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -103.01 20.9 16.7 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.606 0.762 . . . . 0.0 111.987 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -80.16 119.64 77.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 118.697 0.681 . . . . 0.0 110.132 -176.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.18 -28.69 2.3 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.346 2.697 . . . . 0.0 112.128 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -60.87 -41.07 95.25 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.67 1.188 . . . . 0.0 112.076 -172.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.22 162.41 15.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.018 0.927 . . . . 0.0 110.086 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -89.85 -179.47 5.74 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.714 0.806 . . . . 0.0 108.983 169.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.94 -50.15 67.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -60.61 -55.48 32.79 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.045 0.538 . . . . 0.0 111.345 -173.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.02 -36.82 84.3 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.82 0.448 . . . . 0.0 111.36 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.2 ttp-105 -60.88 -49.26 78.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.932 0.493 . . . . 0.0 110.762 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -60.64 -39.39 88.1 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.176 0.59 . . . . 0.0 110.949 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.65 -38.68 88.63 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 117.962 0.347 . . . . 0.0 111.125 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -64.83 -49.81 69.14 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.794 0.838 . . . . 0.0 109.971 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.0 mm -52.84 -47.31 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.408 1.083 . . . . 0.0 110.178 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -59.44 -46.76 87.83 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.452 0.701 . . . . 0.0 110.833 178.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -59.01 -44.57 91.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 111.402 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.41 -47.91 86.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.2 ttm105 -60.34 -42.55 95.93 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.947 0.499 . . . . 0.0 111.888 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -61.98 -48.98 77.92 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.29 0.636 . . . . 0.0 110.461 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -60.51 -54.29 47.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.387 1.075 . . . . 0.0 111.407 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 96.9 m -71.24 -43.94 66.29 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.562 1.145 . . . . 0.0 111.65 -173.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.081 0 O-C-N 122.013 -0.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -163.84 164.84 23.37 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.403 1.081 . . . . 0.0 109.759 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.1 mtt -74.71 72.21 1.98 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.427 1.491 . . . . 0.0 111.885 -169.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 179.44 -42.89 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 127.881 2.472 . . . . 0.0 107.842 176.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.3 m -61.24 -43.9 98.12 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.21 1.004 . . . . 0.0 109.568 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.64 -44.66 96.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.887 0.875 . . . . 0.0 110.952 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -61.16 -46.93 88.51 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.966 0.906 . . . . 0.0 110.618 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -60.55 -46.05 91.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.689 1.196 . . . . 0.0 110.871 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -58.5 -52.95 63.49 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.738 0.415 . . . . 0.0 110.462 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -56.33 -48.25 77.12 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.08 0.952 . . . . 0.0 111.138 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.98 -59.02 5.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.099 0.96 . . . . 0.0 110.346 177.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -47.18 73.34 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.208 1.003 . . . . 0.0 111.716 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 43.4 tp -55.52 -29.28 58.59 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.381 1.472 . . . . 0.0 112.466 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -116.3 16.38 15.79 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.87 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -77.39 119.54 77.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-O 118.669 -0.682 . . . . 0.0 109.647 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.63 -37.18 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.986 2.457 . . . . 0.0 111.814 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -63.71 -38.76 92.31 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.304 1.042 . . . . 0.0 111.399 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -89.15 137.22 32.52 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -89.08 -173.34 4.02 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.55 0.74 . . . . 0.0 109.313 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.59 -42.83 79.37 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.864 0.465 . . . . 0.0 112.115 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.02 -57.01 12.13 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.683 0.793 . . . . 0.0 110.309 -177.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.75 -44.24 93.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.048 0.939 . . . . 0.0 110.924 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -55.36 -56.13 23.66 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.309 1.043 . . . . 0.0 110.109 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.67 -43.05 75.96 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.381 0.673 . . . . 0.0 111.255 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.51 -38.15 80.17 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.94 0.496 . . . . 0.0 111.416 174.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -66.13 -50.37 64.21 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.929 0.892 . . . . 0.0 110.534 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.0 mm -57.74 -41.12 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.093 0.557 . . . . 0.0 109.932 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -61.54 -46.19 90.97 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.261 0.624 . . . . 0.0 111.481 176.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.7 p -63.13 -42.03 99.42 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.172 0.442 . . . . 0.0 111.358 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 54.5 mt -63.79 -53.0 50.01 Favored 'Isoleucine or valine' 0 C--N 1.342 0.253 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -61.97 -38.79 89.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.277 0.49 . . . . 0.0 111.153 -175.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.77 -53.46 53.99 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.855 0.862 . . . . 0.0 110.805 175.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.6 -55.98 27.14 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.912 1.285 . . . . 0.0 111.408 -178.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.9 m -73.4 -36.81 66.08 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 111.763 -175.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.082 0 O-C-N 122.101 -0.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.2 p30 -72.98 173.92 8.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.581 0.752 . . . . 0.0 112.514 -175.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 mmt -60.93 -34.71 75.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.369 1.068 . . . . 0.0 112.652 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -44.84 84.1 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.615 0.766 . . . . 0.0 109.745 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -60.19 -52.13 66.61 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.865 0.866 . . . . 0.0 110.328 175.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -51.05 -50.11 59.25 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.507 1.123 . . . . 0.0 111.389 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 51.7 ttm-85 -55.2 -51.65 65.87 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.576 1.151 . . . . 0.0 110.698 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.95 -42.25 97.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.049 0.54 . . . . 0.0 111.733 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -59.75 -51.4 69.93 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.509 0.595 . . . . 0.0 110.14 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -55.76 -48.66 74.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.308 1.043 . . . . 0.0 111.031 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.99 -55.33 34.09 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.568 0.747 . . . . 0.0 110.221 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.84 -48.13 78.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.377 1.071 . . . . 0.0 111.77 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.77 -41.21 61.45 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.763 0.825 . . . . 0.0 110.926 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -103.22 54.7 0.76 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.114 0.966 . . . . 0.0 109.992 -177.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -129.43 81.88 69.01 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 123.833 0.853 . . . . 0.0 110.166 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.17 -37.25 38.54 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 125.04 3.826 . . . . 0.0 114.281 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -56.64 -35.0 67.86 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.194 0.998 . . . . 0.0 111.884 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.5 mt -89.57 138.41 31.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -88.83 -177.04 5.41 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -51.96 -47.68 64.69 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -61.51 -60.4 3.76 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.422 0.689 . . . . 0.0 110.615 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -58.21 -44.8 88.33 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.517 0.727 . . . . 0.0 111.14 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -62.31 -50.7 70.6 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.954 0.902 . . . . 0.0 110.397 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.4 -41.35 84.73 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.878 0.471 . . . . 0.0 110.956 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.05 89.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.809 0.444 . . . . 0.0 111.174 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -62.83 -50.59 70.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.917 0.887 . . . . 0.0 110.016 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 32.7 mm -53.96 -49.56 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 123.848 0.859 . . . . 0.0 109.875 175.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -56.54 -47.23 79.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.518 0.727 . . . . 0.0 110.954 179.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -58.11 -47.82 82.09 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.637 0.775 . . . . 0.0 111.446 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 51.6 mt -58.33 -48.41 85.08 Favored 'Isoleucine or valine' 0 C--N 1.341 0.234 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -63.91 -34.54 78.18 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.441 0.696 . . . . 0.0 112.126 -175.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -66.88 -51.39 56.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.461 0.705 . . . . 0.0 109.9 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.05 -47.38 74.88 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.599 1.16 . . . . 0.0 111.391 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.8 m -77.2 -37.45 53.53 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.787 -175.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.049 0 O-C-N 122.031 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 120.011 -0.042 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -72.6 176.5 5.41 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.524 0.73 . . . . 0.0 111.919 -176.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 45.2 tpp -48.98 -51.74 28.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.544 1.537 . . . . 0.0 112.019 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.09 -47.2 87.39 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.75 0.42 . . . . 0.0 110.469 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -61.68 -50.09 73.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.774 0.43 . . . . 0.0 111.292 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -36.07 80.1 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -62.75 -50.86 69.39 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.301 0.64 . . . . 0.0 109.618 176.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -58.57 -43.99 89.57 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.382 0.673 . . . . 0.0 111.242 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -55.38 -54.06 48.39 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 118.697 0.681 . . . . 0.0 110.283 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -54.03 -58.81 5.91 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.125 0.97 . . . . 0.0 111.384 -175.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.69 -40.03 95.84 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.23 99.1 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.216 0.607 . . . . 0.0 111.348 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -51.09 71.09 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -89.34 49.03 1.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.588 0.755 . . . . 0.0 110.494 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -117.88 98.95 52.01 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 124.417 1.087 . . . . 0.0 108.587 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.45 -23.97 14.53 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.09 2.526 . . . . 0.0 112.019 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -61.34 -37.01 81.74 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.899 0.879 . . . . 0.0 110.655 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.28 146.66 24.58 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.179 0.992 . . . . 0.0 108.761 177.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -89.32 -177.29 5.34 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -57.85 -46.07 85.34 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.065 0.946 . . . . 0.0 111.467 -176.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -57.94 -57.79 11.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.349 0.66 . . . . 0.0 110.276 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.47 -47.67 75.74 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.129 0.972 . . . . 0.0 110.929 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm105 -55.1 -57.57 11.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.768 1.227 . . . . 0.0 110.511 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -59.08 -39.37 81.95 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.943 0.497 . . . . 0.0 111.597 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.67 91.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.215 0.461 . . . . 0.0 111.244 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -65.23 -48.59 72.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.021 0.928 . . . . 0.0 109.87 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -55.68 -46.35 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.641 0.777 . . . . 0.0 110.143 175.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -58.13 -43.6 87.33 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.226 0.61 . . . . 0.0 111.021 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -60.4 -48.28 82.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.921 0.488 . . . . 0.0 111.192 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.74 -46.27 96.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 123.334 0.654 . . . . 0.0 110.179 178.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -62.75 -31.56 72.53 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.326 1.05 . . . . 0.0 111.509 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.23 -44.46 62.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.275 0.63 . . . . 0.0 109.925 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.81 -51.86 67.86 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.161 0.984 . . . . 0.0 110.661 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -50.52 64.42 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.793 0.437 . . . . 0.0 110.803 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.135 0 O-C-N 122.443 -0.16 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.7 p-10 -88.06 -178.01 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.615 0.766 . . . . 0.0 109.732 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 92.4 mmm -57.29 -38.81 74.53 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.341 0.656 . . . . 0.0 112.059 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.66 -57.72 10.9 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.706 0.402 . . . . 0.0 110.373 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.4 m -63.0 -44.0 97.23 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.857 0.463 . . . . 0.0 111.169 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.97 -55.97 19.53 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.36 1.064 . . . . 0.0 111.188 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -60.81 -45.35 94.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.872 0.869 . . . . 0.0 110.682 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -65.18 -37.12 86.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.765 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.36 -55.09 39.17 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.022 0.828 . . . . 0.0 109.659 174.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -52.26 -53.7 40.57 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.237 1.015 . . . . 0.0 110.517 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -54.25 -57.18 12.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.596 0.759 . . . . 0.0 110.804 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.1 -45.54 71.86 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.977 0.911 . . . . 0.0 111.912 -177.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.39 -47.13 63.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.828 1.251 . . . . 0.0 110.487 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -89.33 -19.81 24.82 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.599 0.76 . . . . 0.0 112.246 -173.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.74 117.85 24.18 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.421 1.089 . . . . 0.0 111.316 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -82.73 -24.66 3.33 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.557 2.838 . . . . 0.0 112.069 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -58.93 -38.72 79.62 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.474 1.11 . . . . 0.0 111.754 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -89.13 147.94 23.94 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -89.13 -179.74 5.96 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.628 0.771 . . . . 0.0 108.954 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.05 -48.64 61.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.516 0.726 . . . . 0.0 111.774 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -60.36 -58.63 7.7 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.91 0.884 . . . . 0.0 110.719 -175.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -66.32 -33.13 75.03 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.485 0.714 . . . . 0.0 111.834 -177.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -66.51 -48.7 68.94 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.844 0.857 . . . . 0.0 110.564 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.27 -39.49 94.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.153 0.433 . . . . 0.0 110.834 176.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.25 -42.98 96.47 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.72 0.408 . . . . 0.0 111.079 175.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.76 -50.95 71.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.084 0.954 . . . . 0.0 110.264 176.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.7 mm -52.28 -51.05 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.089 0.555 . . . . 0.0 110.003 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.7 -43.77 85.41 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.43 0.692 . . . . 0.0 111.527 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -59.13 -47.49 85.09 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.996 0.519 . . . . 0.0 110.751 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.6 mt -64.12 -42.55 95.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.422 0.689 . . . . 0.0 110.21 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -58.32 -39.31 79.07 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.004 0.521 . . . . 0.0 110.887 174.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.59 -41.39 72.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.552 0.741 . . . . 0.0 110.495 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -54.78 -57.07 13.02 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.455 1.102 . . . . 0.0 111.013 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 57.2 m -76.49 -52.0 10.66 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 117.661 0.209 . . . . 0.0 111.043 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.089 0 O-C-N 122.018 -0.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.348 0.129 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -158.13 -174.83 5.01 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.322 1.049 . . . . 0.0 109.737 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -54.21 -43.44 70.78 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.798 1.239 . . . . 0.0 111.5 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -59.49 -39.67 84.53 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.392 0.677 . . . . 0.0 111.339 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.0 m -62.35 -46.92 86.51 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.69 0.396 . . . . 0.0 109.95 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -60.49 -47.65 85.22 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 122.888 0.475 . . . . 0.0 111.413 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -55.21 -49.6 71.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.679 1.191 . . . . 0.0 110.616 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.21 -40.69 96.58 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.792 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -58.54 -52.74 64.38 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.909 0.777 . . . . 0.0 110.437 176.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -54.93 -52.4 63.07 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.54 1.136 . . . . 0.0 110.687 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.28 -55.82 27.08 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.54 0.736 . . . . 0.0 110.071 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.0 -46.43 71.74 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 111.561 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.02 -50.1 48.59 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.243 1.017 . . . . 0.0 109.966 177.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.01 3.08 54.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.935 0.894 . . . . 0.0 113.031 -175.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -73.21 122.06 86.69 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 119.008 0.822 . . . . 0.0 110.89 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -80.15 -28.47 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.256 2.637 . . . . 0.0 112.037 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -60.55 -47.07 87.82 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.185 0.994 . . . . 0.0 111.769 -171.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.9 mt -89.49 150.27 22.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.72 0.808 . . . . 0.0 109.541 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -89.46 -174.76 4.48 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.01 0.924 . . . . 0.0 109.274 175.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -51.39 -52.7 43.65 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.556 1.142 . . . . 0.0 111.911 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -65.69 -51.1 62.04 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.41 0.684 . . . . 0.0 111.054 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.75 -33.88 74.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.229 0.611 . . . . 0.0 111.251 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -61.2 -50.2 74.09 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.067 0.547 . . . . 0.0 109.794 172.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.43 -40.63 95.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.545 0.338 . . . . 0.0 111.006 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.14 -46.72 85.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.646 0.778 . . . . 0.0 110.856 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -59.07 -52.54 65.29 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.547 0.739 . . . . 0.0 110.113 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.0 mm -51.48 -58.17 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.84 0.856 . . . . 0.0 110.875 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.23 -35.7 81.69 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.7 p -63.89 -45.59 88.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.357 0.526 . . . . 0.0 110.668 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 39.8 mt -59.76 -48.04 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 119.013 -0.517 . . . . 0.0 109.635 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 41.3 mtm105 -57.89 -37.73 74.52 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.758 0.708 . . . . 0.0 111.934 177.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -67.05 -49.38 65.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.968 0.507 . . . . 0.0 109.868 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.27 -48.76 80.42 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.378 1.071 . . . . 0.0 111.131 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.3 m -70.19 -36.18 74.45 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.139 1.376 . . . . 0.0 111.813 -177.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.065 0 O-C-N 122.031 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.154 0.025 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -117.73 -61.9 1.63 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.172 1.389 . . . . 0.0 111.613 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 75.6 mtm -90.39 -127.68 0.08 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.298 1.039 . . . . 0.0 110.54 -173.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -56.49 -40.77 75.5 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.337 1.055 . . . . 0.0 111.318 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.5 m -53.67 -37.95 63.68 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.741 1.216 . . . . 0.0 112.225 177.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -61.38 -45.21 95.31 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.77 -34.06 73.25 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.393 0.677 . . . . 0.0 110.785 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -63.29 -49.24 74.8 Favored 'General case' 0 C--N 1.341 0.224 0 C-N-CA 123.529 0.732 . . . . 0.0 110.135 173.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -59.14 -46.09 89.27 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.691 0.396 . . . . 0.0 111.151 176.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -57.31 -50.68 72.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.441 1.097 . . . . 0.0 110.681 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.91 -52.34 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.567 0.747 . . . . 0.0 110.686 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.67 -42.63 75.39 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.37 1.068 . . . . 0.0 111.597 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.55 -51.96 67.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.688 0.795 . . . . 0.0 110.005 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -91.57 62.98 4.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.777 0.831 . . . . 0.0 110.22 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -133.62 83.02 49.5 Favored Pre-proline 0 CA--C 1.536 0.44 0 C-N-CA 123.685 0.794 . . . . 0.0 109.47 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.38 -29.09 29.47 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 124.777 3.652 . . . . 0.0 114.798 -178.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -59.45 -29.68 67.97 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.794 0.838 . . . . 0.0 112.241 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.7 mt -89.51 165.1 14.5 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.338 0.655 . . . . 0.0 110.169 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.68 -165.58 1.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.215 1.006 . . . . 0.0 109.281 169.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -47.01 -75.81 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.293 1.437 . . . . 0.0 113.526 -170.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -60.51 -40.44 91.45 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -57.17 -52.83 63.75 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.943 0.897 . . . . 0.0 110.882 176.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.5 ttm-85 -61.06 -52.6 64.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.958 0.903 . . . . 0.0 110.313 -178.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -56.55 -42.56 78.76 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.908 0.483 . . . . 0.0 111.194 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.79 85.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.11 0.564 . . . . 0.0 111.436 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -62.12 -48.34 80.59 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.704 0.802 . . . . 0.0 109.841 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.88 -37.26 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.661 0.784 . . . . 0.0 110.297 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -61.73 -52.0 66.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.083 0.953 . . . . 0.0 110.327 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -59.15 -43.11 92.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.683 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.8 mt -60.58 -47.04 94.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 118.479 0.581 . . . . 0.0 109.931 176.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -55.13 -39.81 69.83 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 118.529 0.604 . . . . 0.0 111.904 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -67.64 -49.07 64.75 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 118.164 0.438 . . . . 0.0 110.14 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -60.36 -49.98 75.42 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.483 1.113 . . . . 0.0 111.248 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -75.22 -44.22 47.42 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.585 1.154 . . . . 0.0 111.472 -174.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.09 0 O-C-N 122.043 -0.411 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -168.26 -174.47 2.29 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.552 1.141 . . . . 0.0 109.295 -172.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.5 mtt -56.51 150.12 15.91 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.939 0.895 . . . . 0.0 110.435 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 76.57 -50.71 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.097 1.759 . . . . 0.0 111.454 -175.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.12 -55.47 33.43 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.532 0.605 . . . . 0.0 109.787 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -60.9 -37.9 83.84 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.502 0.721 . . . . 0.0 111.904 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -61.06 -49.72 76.2 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.54 0.736 . . . . 0.0 109.987 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.56 -37.2 86.01 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.536 0.735 . . . . 0.0 111.523 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -58.85 -54.77 43.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.771 0.714 . . . . 0.0 110.248 174.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -55.86 -49.04 74.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.941 1.296 . . . . 0.0 111.066 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -55.69 -53.43 56.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.829 1.252 . . . . 0.0 110.802 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.61 87.43 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.339 1.056 . . . . 0.0 111.478 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.35 -48.18 74.62 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.491 0.717 . . . . 0.0 109.316 175.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -94.68 41.74 1.09 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.81 0.844 . . . . 0.0 111.17 -177.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -117.77 90.47 36.28 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.215 1.006 . . . . 0.0 108.523 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.74 -25.57 20.28 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.042 2.494 . . . . 0.0 112.01 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -60.3 -35.79 76.39 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.778 0.831 . . . . 0.0 110.972 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.2 mt -89.37 140.01 29.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -89.08 -175.4 4.8 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.405 0.682 . . . . 0.0 109.658 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -51.42 -50.0 60.53 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.938 0.895 . . . . 0.0 111.471 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.4 -54.37 37.77 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.209 0.604 . . . . 0.0 111.199 -174.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -59.76 -45.33 92.57 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.63 0.772 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -57.54 -56.53 20.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.003 0.921 . . . . 0.0 110.241 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.64 -42.38 88.15 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.581 . . . . 0.0 111.179 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.07 -48.16 82.59 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.973 0.509 . . . . 0.0 110.97 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.44 -50.49 73.52 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.927 0.891 . . . . 0.0 110.692 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.8 mm -51.74 -52.72 20.4 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.146 0.978 . . . . 0.0 110.025 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -56.57 -49.1 75.86 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.166 0.586 . . . . 0.0 111.468 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -54.26 -51.51 64.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.985 0.514 . . . . 0.0 111.219 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.6 mt -60.03 -45.52 95.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.226 0.611 . . . . 0.0 110.053 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -57.55 -39.61 77.03 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 123.22 0.608 . . . . 0.0 111.685 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -69.2 -46.16 68.14 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.752 0.421 . . . . 0.0 109.883 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -58.85 -49.89 76.04 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.285 1.034 . . . . 0.0 111.075 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.0 m -73.37 -38.33 65.71 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.572 1.149 . . . . 0.0 111.703 -176.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.123 0 O-C-N 122.074 -0.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 111.278 0.103 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -162.18 -44.6 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.285 0.634 . . . . 0.0 111.541 -172.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptp -82.6 -161.15 0.44 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.685 1.194 . . . . 0.0 111.394 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -46.79 -28.56 1.58 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.92 1.688 . . . . 0.0 113.779 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -46.12 -45.79 16.69 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.341 1.457 . . . . 0.0 111.473 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.42 -49.22 75.15 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.84 0.856 . . . . 0.0 111.622 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.94 -42.4 90.09 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.151 0.98 . . . . 0.0 109.604 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -60.85 -44.93 96.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.352 1.061 . . . . 0.0 110.983 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -60.39 -50.42 73.66 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.253 0.621 . . . . 0.0 110.344 176.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -54.84 -51.49 65.73 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.932 0.893 . . . . 0.0 110.805 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -56.0 -54.48 44.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.757 0.823 . . . . 0.0 110.41 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.06 -40.68 73.93 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.391 1.076 . . . . 0.0 111.831 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -52.18 66.78 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -89.8 51.47 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.956 0.902 . . . . 0.0 110.358 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -119.38 81.32 22.51 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.283 1.033 . . . . 0.0 109.458 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.2 -20.3 24.91 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.203 2.602 . . . . 0.0 111.886 177.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -60.86 -37.01 80.63 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.851 0.861 . . . . 0.0 110.866 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -89.28 159.3 17.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.493 0.717 . . . . 0.0 109.413 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 -89.54 175.08 7.43 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.763 0.825 . . . . 0.0 108.81 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.38 -33.2 72.12 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.86 -63.2 1.38 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.806 0.843 . . . . 0.0 110.898 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.42 -35.47 81.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.805 0.442 . . . . 0.0 110.885 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.2 ttp-105 -61.2 -52.55 64.32 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.071 0.549 . . . . 0.0 111.108 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -63.88 -38.35 90.77 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.731 0.696 . . . . 0.0 110.946 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -42.96 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.752 0.421 . . . . 0.0 110.821 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -61.07 -48.85 79.82 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.71 0.804 . . . . 0.0 110.387 177.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.1 -49.64 60.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 123.426 0.691 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -58.18 -42.67 86.59 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.739 0.816 . . . . 0.0 111.253 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -59.68 -48.63 80.91 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 122.865 0.466 . . . . 0.0 111.263 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.15 -46.93 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 118.268 0.485 . . . . 0.0 109.971 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -61.31 -33.81 74.21 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.593 0.757 . . . . 0.0 111.815 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -70.83 -44.94 65.44 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.172 0.589 . . . . 0.0 110.143 175.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -58.47 -52.6 64.95 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.423 1.089 . . . . 0.0 110.716 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -47.83 68.28 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.818 0.447 . . . . 0.0 110.834 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.055 0 O-C-N 122.276 -0.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 44.2 p30 -163.28 169.91 18.43 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.677 1.191 . . . . 0.0 109.453 -173.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 82.0 mtp -81.92 60.52 4.81 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.611 0.764 . . . . 0.0 110.347 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.446 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 13.1 pt20 -163.66 -47.67 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.907 1.683 . . . . 0.0 109.112 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.5 m -68.93 -37.67 79.05 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 171.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -58.84 -42.63 89.74 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.835 0.454 . . . . 0.0 110.676 171.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 90.7 mtt-85 -63.25 -42.57 99.2 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.978 0.511 . . . . 0.0 110.416 177.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 9' ' ' GLN . 28.5 mmm180 -56.97 -51.12 70.49 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.052 0.541 . . . . 0.0 110.884 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -57.0 -52.62 64.56 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 122.571 0.348 . . . . 0.0 110.843 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -51.3 -59.73 3.9 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.349 1.06 . . . . 0.0 110.81 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -54.75 -48.42 72.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.759 0.824 . . . . 0.0 111.243 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.09 -45.95 86.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.748 0.819 . . . . 0.0 112.212 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.5 mt -59.77 -39.91 86.47 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.081 0.952 . . . . 0.0 111.942 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -89.2 -36.84 15.42 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.882 0.473 . . . . 0.0 111.543 -172.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.36 134.18 95.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.6 -126.48 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.945 2.43 . . . . 0.0 107.581 174.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 55.85 17.72 2.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.746 1.218 . . . . 0.0 113.289 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.3 mt -150.03 134.03 17.0 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.43 1.492 . . . . 0.0 107.64 -170.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.1 p30 -89.79 -176.36 4.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 169.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.79 -52.47 65.33 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.039 0.536 . . . . 0.0 111.195 -177.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -61.27 -53.33 58.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.289 0.636 . . . . 0.0 110.971 -174.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -62.39 -42.55 99.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.5 ttp85 -56.32 -61.46 2.39 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.013 0.525 . . . . 0.0 110.171 176.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -60.14 -35.87 76.24 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.251 -0.404 . . . . 0.0 111.986 -176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.69 -43.12 99.63 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.048 0.539 . . . . 0.0 111.295 175.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -69.64 -45.26 68.87 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 110.162 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.7 mm -54.47 -48.12 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.045 0.938 . . . . 0.0 110.017 172.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -58.14 -45.41 87.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.836 0.854 . . . . 0.0 110.911 177.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -57.68 -48.4 79.65 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.939 0.496 . . . . 0.0 111.057 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -57.96 -52.63 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.136 0.574 . . . . 0.0 109.64 176.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -57.28 -43.36 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.152 0.981 . . . . 0.0 112.065 -177.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.04 -47.86 73.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.391 0.677 . . . . 0.0 110.319 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -51.97 67.61 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.024 0.93 . . . . 0.0 111.374 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 72.4 m -69.53 -38.5 77.54 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.805 1.242 . . . . 0.0 111.282 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.099 0 O-C-N 122.199 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -159.27 178.32 10.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.849 0.86 . . . . 0.0 109.783 -178.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 79.5 mtm -43.63 -47.29 7.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.747 1.619 . . . . 0.0 112.764 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -69.13 -57.17 5.75 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.394 0.678 . . . . 0.0 111.329 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 m -61.72 -35.3 77.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.585 0.629 . . . . 0.0 111.862 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -59.89 -55.27 36.23 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.388 0.54 . . . . 0.0 111.678 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.67 -30.62 71.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.427 0.558 . . . . 0.0 111.882 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -65.69 -43.11 90.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.205 0.602 . . . . 0.0 110.798 174.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -59.63 -50.86 72.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.916 0.78 . . . . 0.0 110.348 174.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -54.75 -49.8 69.96 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.291 1.037 . . . . 0.0 110.637 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -55.81 -54.03 49.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.895 0.878 . . . . 0.0 110.354 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.88 -47.0 71.51 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.19 0.996 . . . . 0.0 112.166 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.6 mt -53.59 -39.4 64.83 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.983 0.913 . . . . 0.0 112.182 177.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -98.92 -20.07 17.0 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.79 0.836 . . . . 0.0 113.166 -169.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.76 122.95 79.77 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.414 0.686 . . . . 0.0 110.493 -173.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.49 -29.31 11.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.479 2.786 . . . . 0.0 112.668 -173.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -63.53 -28.3 69.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.464 0.705 . . . . 0.0 111.203 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.4 mt -89.63 128.48 36.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -88.8 -165.97 1.48 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.16 -51.32 70.21 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.918 0.487 . . . . 0.0 111.001 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -58.24 -57.29 13.51 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.15 0.98 . . . . 0.0 110.598 -177.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -56.48 -41.98 77.49 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.148 1.379 . . . . 0.0 110.881 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.87 -55.22 28.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.346 0.658 . . . . 0.0 109.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -58.07 -41.21 82.9 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.819 0.736 . . . . 0.0 111.326 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.85 -44.4 94.14 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.802 0.441 . . . . 0.0 111.204 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.44 -50.43 72.83 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.14 0.976 . . . . 0.0 110.472 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.1 mm -52.69 -49.36 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.867 0.867 . . . . 0.0 110.084 175.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.5 -47.52 76.09 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.049 0.94 . . . . 0.0 110.94 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.5 m -60.76 -41.22 95.02 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.414 0.686 . . . . 0.0 112.027 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.5 mt -67.66 -49.62 68.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.496 -177.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -65.62 -36.48 83.85 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 118.202 0.455 . . . . 0.0 111.7 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.19 -46.22 90.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.086 0.555 . . . . 0.0 110.602 172.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -58.16 -57.22 13.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.455 1.102 . . . . 0.0 111.595 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.63 -34.97 70.24 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.914 0.325 . . . . 0.0 111.807 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.104 0 O-C-N 121.971 -0.456 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 16.2 p30 -170.2 169.01 8.01 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.784 1.234 . . . . 0.0 109.278 -173.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.0 mmt -81.81 57.59 3.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 0.0 110.825 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -153.31 -53.82 0.11 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.23 1.812 . . . . 0.0 106.464 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.7 m -59.47 -43.86 93.16 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 124.082 0.953 . . . . 0.0 109.717 169.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -60.12 -43.79 95.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.125 0.57 . . . . 0.0 110.75 173.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -64.22 -37.6 88.07 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.187 0.595 . . . . 0.0 111.158 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -65.52 -46.38 79.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.119 0.968 . . . . 0.0 110.403 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.85 -54.79 42.94 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.285 0.493 . . . . 0.0 110.518 173.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -53.4 -48.4 68.72 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.777 1.631 . . . . 0.0 111.09 -177.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.09 -51.62 68.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.361 1.064 . . . . 0.0 110.782 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.98 -44.89 79.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.603 0.761 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -59.82 -52.71 64.28 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.823 0.849 . . . . 0.0 110.339 175.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -89.75 53.73 2.65 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.345 0.658 . . . . 0.0 110.501 -174.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -160.26 136.78 6.45 Favored Pre-proline 0 N--CA 1.453 -0.281 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -80.17 -129.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.845 2.363 . . . . 0.0 107.453 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 56.34 13.42 1.27 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.884 1.273 . . . . 0.0 113.429 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.5 mt -150.03 132.01 15.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.53 1.532 . . . . 0.0 107.392 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -89.8 -172.72 3.64 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -51.63 -52.56 46.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.374 0.669 . . . . 0.0 110.775 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -59.14 -56.83 17.1 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.701 0.8 . . . . 0.0 110.91 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -60.89 -40.46 93.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.898 0.879 . . . . 0.0 111.376 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.28 -57.3 13.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.569 0.748 . . . . 0.0 110.259 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -62.36 -35.7 79.95 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.256 -178.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.97 -43.76 98.16 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.049 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.22 -50.69 72.07 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.596 0.758 . . . . 0.0 110.299 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.17 -47.84 76.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 122.831 0.452 . . . . 0.0 110.106 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.9 tttp -58.42 -44.34 89.03 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.346 0.658 . . . . 0.0 111.247 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.4 m -61.68 -48.31 81.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.586 0.754 . . . . 0.0 111.084 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 49.8 mt -60.64 -47.63 92.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 123.587 0.755 . . . . 0.0 109.834 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 51.4 ttm-85 -64.21 -39.83 94.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.218 1.007 . . . . 0.0 111.674 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -65.0 -50.44 66.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.776 0.83 . . . . 0.0 110.355 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.76 -52.95 62.18 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.796 1.238 . . . . 0.0 111.216 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 94.9 m -70.83 -37.82 73.21 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.123 0.969 . . . . 0.0 111.733 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.093 0 O-C-N 122.094 -0.379 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 110.571 -0.159 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -74.57 178.59 5.24 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.928 0.491 . . . . 0.0 110.788 178.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.2 ptp -52.77 -41.36 64.01 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.752 0.821 . . . . 0.0 112.578 -178.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -63.27 -43.83 96.82 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.193 0.451 . . . . 0.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.53 -45.56 86.66 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.93 0.492 . . . . 0.0 110.58 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -54.87 -54.46 42.18 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.689 0.796 . . . . 0.0 110.643 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.0 -42.71 80.79 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.88 1.272 . . . . 0.0 110.834 177.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.3 -51.32 70.43 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.135 0.974 . . . . 0.0 111.708 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -58.63 -52.47 65.55 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 118.068 0.395 . . . . 0.0 110.407 177.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -54.66 -51.3 65.9 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.186 0.994 . . . . 0.0 111.42 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.98 -53.38 59.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.618 1.167 . . . . 0.0 110.764 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -39.19 90.97 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.88 0.872 . . . . 0.0 112.117 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 mt -57.83 -52.0 67.29 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.042 0.537 . . . . 0.0 109.721 173.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.32 0.648 . . . . 0.0 110.139 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -126.03 92.86 45.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.689 1.195 . . . . 0.0 108.509 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -72.81 -28.21 13.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.051 2.5 . . . . 0.0 111.92 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -60.59 -33.01 72.09 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.974 0.91 . . . . 0.0 111.2 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.13 137.18 32.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -88.77 172.72 9.02 Favored 'General case' 0 C--N 1.338 0.085 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -50.92 -41.16 58.53 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.323 0.649 . . . . 0.0 112.524 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.36 -62.38 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.188 0.595 . . . . 0.0 110.93 -176.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -64.65 -37.57 88.01 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.233 0.613 . . . . 0.0 111.012 -176.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -59.83 -54.67 43.55 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.959 0.904 . . . . 0.0 110.619 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.99 -40.53 95.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.163 0.438 . . . . 0.0 110.94 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.06 91.02 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.048 0.539 . . . . 0.0 110.916 175.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -50.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.809 0.444 . . . . 0.0 110.237 178.126 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.2 mm -53.24 -46.25 56.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.177 0.991 . . . . 0.0 110.127 178.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.69 -46.99 87.4 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.586 0.754 . . . . 0.0 111.016 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.2 t -61.92 -47.96 82.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.437 0.695 . . . . 0.0 111.282 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.75 -45.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 124.329 1.052 . . . . 0.0 109.125 177.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -64.08 -40.86 97.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.896 0.878 . . . . 0.0 111.598 -178.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.96 -48.6 81.04 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.264 0.626 . . . . 0.0 110.417 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.07 -51.62 67.2 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.786 0.834 . . . . 0.0 111.514 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 93.7 m -68.18 -35.04 77.39 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.185 1.394 . . . . 0.0 112.157 -175.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.091 0 O-C-N 122.017 -0.427 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 120.271 0.081 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -175.77 -173.71 0.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.304 1.442 . . . . 0.0 109.159 -169.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 86.8 mmm -61.55 -38.85 88.98 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.086 0.954 . . . . 0.0 112.37 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -61.86 -50.45 72.18 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -57.73 -43.48 85.33 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.02 0.928 . . . . 0.0 111.29 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -56.92 -50.97 70.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.718 0.807 . . . . 0.0 110.674 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -63.35 -38.64 91.94 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.749 0.82 . . . . 0.0 111.659 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.7 mtp180 -62.03 -48.27 81.01 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.902 0.881 . . . . 0.0 110.458 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.88 -49.94 75.02 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.111 0.564 . . . . 0.0 111.031 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -57.64 -49.44 76.46 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.128 0.971 . . . . 0.0 110.883 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -55.92 -56.36 21.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.949 0.9 . . . . 0.0 110.15 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -40.65 76.86 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.186 0.994 . . . . 0.0 111.873 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 tp -60.09 -49.48 77.46 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.658 0.783 . . . . 0.0 109.812 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -93.39 58.44 2.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.75 0.82 . . . . 0.0 109.928 -178.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -129.11 86.89 55.78 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.803 0.841 . . . . 0.0 110.564 -178.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.57 -26.36 78.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 124.036 3.157 . . . . 0.0 113.318 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -55.39 -45.12 76.64 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.963 1.305 . . . . 0.0 111.855 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.0 mt -89.28 163.64 15.28 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.575 0.75 . . . . 0.0 109.644 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -89.41 -175.53 4.76 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.573 0.749 . . . . 0.0 109.37 174.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.3 -54.87 30.3 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 111.029 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -56.28 -52.86 62.95 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.567 0.747 . . . . 0.0 110.634 -179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 72.6 mm-40 -60.65 -41.32 94.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 111.981 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ttp-105 -64.44 -46.97 80.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.084 0.554 . . . . 0.0 110.873 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -61.52 -39.08 89.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.106 0.412 . . . . 0.0 110.88 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.87 -44.05 97.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.957 0.503 . . . . 0.0 110.859 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -58.93 -50.59 73.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 0.0 110.507 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.0 mm -53.73 -47.75 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.704 0.802 . . . . 0.0 110.17 175.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.08 -45.2 93.69 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.568 0.747 . . . . 0.0 111.328 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -60.75 -45.57 93.78 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.645 0.778 . . . . 0.0 111.197 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.63 -47.33 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 123.426 0.691 . . . . 0.0 109.638 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -62.26 -43.29 99.16 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.613 0.765 . . . . 0.0 111.853 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.8 -50.82 70.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.842 0.857 . . . . 0.0 110.571 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.82 -53.51 57.41 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.643 1.177 . . . . 0.0 111.282 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.6 m -73.35 -29.44 62.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.33 1.052 . . . . 0.0 112.293 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.098 0 O-C-N 121.863 -0.523 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 . . . . . 0 N--CA 1.474 0.764 0 CA-C-O 120.733 0.301 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -87.48 -175.93 5.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.887 0.875 . . . . 0.0 110.62 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.5 tpt -59.47 -39.01 82.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.73 0.812 . . . . 0.0 112.101 -177.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -56.52 -48.99 76.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.159 0.584 . . . . 0.0 110.135 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.84 -36.36 78.08 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.666 0.787 . . . . 0.0 111.732 -178.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.9 tm0? -56.0 -53.02 61.93 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.415 0.686 . . . . 0.0 109.995 170.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -59.16 -41.76 89.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.165 0.986 . . . . 0.0 111.395 179.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -61.48 -49.39 76.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.364 0.666 . . . . 0.0 111.009 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -56.23 -56.08 25.42 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.232 0.469 . . . . 0.0 110.391 176.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -53.33 -52.77 58.1 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.209 1.404 . . . . 0.0 110.917 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -54.73 -55.76 26.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.165 0.986 . . . . 0.0 110.292 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.81 -44.28 70.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.708 0.803 . . . . 0.0 111.853 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.56 -46.85 63.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.069 1.348 . . . . 0.0 110.679 178.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -89.73 -30.8 17.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.669 0.788 . . . . 0.0 112.782 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -57.01 110.79 2.66 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 111.926 -169.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.15 -22.44 22.47 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.055 2.503 . . . . 0.0 112.126 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -61.3 -27.61 68.6 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.19 0.596 . . . . 0.0 111.011 175.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -89.61 132.36 35.15 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 172.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.4 p30 -89.18 -174.18 4.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 171.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.56 -44.02 68.93 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.54 0.736 . . . . 0.0 112.672 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.57 -59.83 3.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.365 1.066 . . . . 0.0 109.954 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -52.87 -46.68 68.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.927 1.291 . . . . 0.0 110.63 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 ttp-105 -61.97 -57.13 12.88 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.329 1.052 . . . . 0.0 111.327 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -61.22 -41.38 96.76 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.277 0.944 . . . . 0.0 111.077 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.71 -46.56 81.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.419 0.688 . . . . 0.0 111.016 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.69 -48.48 81.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.094 0.958 . . . . 0.0 110.91 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.7 mm -55.06 -49.43 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 122.901 0.481 . . . . 0.0 110.0 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -59.85 -40.95 90.31 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.929 0.492 . . . . 0.0 111.87 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -60.74 -46.91 88.63 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.92 0.488 . . . . 0.0 110.821 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 33.1 mt -64.94 -41.19 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.642 0.777 . . . . 0.0 109.766 178.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -57.12 -48.3 79.0 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.15 0.98 . . . . 0.0 110.565 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -63.76 -57.45 9.92 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.528 0.731 . . . . 0.0 110.635 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -50.25 -56.06 12.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.482 1.513 . . . . 0.0 111.977 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -91.87 10.82 27.12 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.664 1.185 . . . . 0.0 113.069 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.001 0 O-C-N 121.604 -0.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -72.08 169.11 16.71 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.811 0.444 . . . . 0.0 110.901 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -56.18 -42.67 77.46 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.92 0.888 . . . . 0.0 112.704 -175.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -66.08 -49.3 68.08 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.766 0.426 . . . . 0.0 110.435 -176.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.8 m -58.21 -45.02 88.39 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.032 0.533 . . . . 0.0 110.411 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -58.53 -48.49 80.67 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.665 0.786 . . . . 0.0 111.412 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -55.81 -48.51 75.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.263 1.025 . . . . 0.0 110.57 175.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.2 mtp180 -60.35 -47.15 87.3 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.178 0.591 . . . . 0.0 111.244 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -57.52 -51.14 70.67 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.495 0.718 . . . . 0.0 110.552 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -54.78 -58.96 5.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.386 1.074 . . . . 0.0 110.619 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -53.99 -51.11 64.98 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.53 0.732 . . . . 0.0 111.048 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.76 -49.1 76.27 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.618 0.767 . . . . 0.0 111.509 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.9 -43.14 65.96 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.67 1.188 . . . . 0.0 111.743 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -89.71 -22.64 22.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.441 0.696 . . . . 0.0 112.602 -174.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.95 114.64 6.74 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.241 1.016 . . . . 0.0 111.097 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -76.81 -28.42 6.33 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.094 2.529 . . . . 0.0 111.934 -177.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -56.09 -42.26 76.47 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 124.821 1.249 . . . . 0.0 112.126 -173.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.3 mt -89.26 139.4 30.53 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -88.77 -177.69 5.59 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.023 0.929 . . . . 0.0 108.916 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -46.99 -51.95 15.91 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.793 0.837 . . . . 0.0 112.056 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -63.14 -56.47 16.5 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.564 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -66.86 -43.29 83.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.287 0.635 . . . . 0.0 110.942 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -60.92 -49.46 77.37 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.832 0.853 . . . . 0.0 110.298 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -63.42 -41.67 98.7 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.804 0.842 . . . . 0.0 110.258 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.85 -38.3 75.42 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.569 0.347 . . . . 0.0 111.178 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -62.36 -46.98 86.23 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 110.065 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.7 mm -55.55 -48.23 77.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.084 0.554 . . . . 0.0 110.151 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -57.37 -42.07 81.38 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.75 0.42 . . . . 0.0 111.383 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 m -62.19 -44.08 97.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.235 0.614 . . . . 0.0 111.465 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.66 -45.82 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -60.99 -38.17 85.03 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.671 0.788 . . . . 0.0 111.645 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -66.01 -47.63 73.84 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.453 0.701 . . . . 0.0 110.381 174.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -58.08 -54.6 45.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.4 1.08 . . . . 0.0 111.307 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -47.26 79.7 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.149 0.58 . . . . 0.0 111.553 176.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.113 0 O-C-N 122.311 -0.243 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -155.53 179.26 9.35 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.151 0.98 . . . . 0.0 110.194 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.9 tpp -58.31 -37.42 75.06 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.976 1.31 . . . . 0.0 111.749 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -62.51 -50.31 71.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.344 0.658 . . . . 0.0 110.591 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.7 -51.74 67.61 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.77 0.428 . . . . 0.0 111.442 174.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -50.84 -55.9 14.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.597 1.159 . . . . 0.0 110.82 -178.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -55.82 -53.9 51.08 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.57 0.748 . . . . 0.0 111.091 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -59.9 -45.5 92.36 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.888 -176.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.1 -56.85 16.41 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.135 0.574 . . . . 0.0 110.281 176.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -49.63 -56.75 8.93 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -55.51 -51.11 68.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.998 0.919 . . . . 0.0 110.919 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.48 87.69 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.619 0.768 . . . . 0.0 112.227 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.5 mt -58.33 -44.67 88.78 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.009 0.924 . . . . 0.0 111.837 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -89.35 -43.61 10.79 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.874 0.47 . . . . 0.0 111.749 -170.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.84 136.27 90.15 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 109.744 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.54 -127.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.864 2.376 . . . . 0.0 107.717 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 54.72 15.62 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.787 1.235 . . . . 0.0 113.49 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.5 mt -150.0 133.18 16.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.431 1.493 . . . . 0.0 107.635 -170.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -89.41 170.79 10.23 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 170.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -48.43 -57.41 6.12 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.282 1.033 . . . . 0.0 112.302 -173.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -57.45 -48.61 78.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.576 0.75 . . . . 0.0 111.35 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -68.54 -35.08 76.94 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.678 0.791 . . . . 0.0 111.533 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -67.33 -48.27 68.04 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.162 0.437 . . . . 0.0 109.859 177.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -59.42 -39.87 84.9 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.615 0.366 . . . . 0.0 111.019 174.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.05 -39.97 94.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.972 0.509 . . . . 0.0 111.303 176.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.5 -50.74 71.49 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.449 0.7 . . . . 0.0 110.196 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.8 mm -55.01 -48.64 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 122.99 0.516 . . . . 0.0 110.388 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -58.71 -45.45 89.51 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.014 0.526 . . . . 0.0 111.197 178.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.5 t -59.24 -46.74 87.68 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.629 0.771 . . . . 0.0 111.023 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -49.3 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 123.983 0.913 . . . . 0.0 109.945 177.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -57.19 -39.45 75.41 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.876 1.271 . . . . 0.0 111.953 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.67 -45.82 67.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.118 0.567 . . . . 0.0 110.344 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.89 -51.46 67.5 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.56 1.144 . . . . 0.0 111.054 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.43 -47.16 64.95 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.338 0.655 . . . . 0.0 110.39 178.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.079 0 CA-C-N 116.733 -0.212 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 111.477 0.176 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -161.38 169.11 22.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.335 1.054 . . . . 0.0 109.807 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -46.35 -44.24 16.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.447 1.499 . . . . 0.0 114.047 -173.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -65.36 -41.59 93.68 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.385 0.539 . . . . 0.0 110.68 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 m -64.74 -49.11 72.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.349 0.66 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -61.13 -44.55 97.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.914 0.486 . . . . 0.0 111.217 179.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -55.17 -51.01 67.85 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.806 1.242 . . . . 0.0 110.56 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -66.46 -38.97 88.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.718 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -58.19 -56.61 19.88 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.848 0.749 . . . . 0.0 110.01 174.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -51.81 -50.74 60.23 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.34 1.456 . . . . 0.0 110.743 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -55.96 -55.17 35.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.739 0.816 . . . . 0.0 110.665 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.23 -39.62 75.91 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.988 0.915 . . . . 0.0 112.121 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.43 -47.71 78.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.79 1.236 . . . . 0.0 110.489 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -89.36 -30.59 18.29 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.484 0.714 . . . . 0.0 111.912 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.11 123.9 67.29 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 124.648 1.179 . . . . 0.0 109.684 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -79.96 -135.98 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.961 2.441 . . . . 0.0 106.151 170.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.6 m120 70.18 -52.24 0.64 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.183 1.793 . . . . 0.0 112.407 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -88.88 151.7 22.18 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 126.269 1.828 . . . . 0.0 108.552 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -89.47 -174.64 4.43 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 172.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -58.18 -46.46 85.71 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.795 0.838 . . . . 0.0 111.717 -175.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -64.57 -48.86 73.43 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.879 -176.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -67.5 -35.09 78.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.166 0.586 . . . . 0.0 111.51 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -61.06 -51.4 69.32 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 172.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -59.94 -37.06 78.41 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.992 0.517 . . . . 0.0 111.122 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.29 97.84 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.402 0.681 . . . . 0.0 110.948 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -59.57 -52.09 67.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.466 0.707 . . . . 0.0 110.253 176.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.6 mm -52.96 -51.09 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.109 0.564 . . . . 0.0 109.98 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -57.33 -46.07 83.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.535 1.134 . . . . 0.0 111.656 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 p -64.41 -38.14 89.98 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.136 0.426 . . . . 0.0 111.672 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.69 -45.34 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.16 -40.91 82.62 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.557 0.743 . . . . 0.0 111.097 176.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.87 -51.18 63.39 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.515 0.726 . . . . 0.0 110.582 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.69 -50.32 66.12 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.076 1.351 . . . . 0.0 111.272 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.1 m -74.73 -38.79 62.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.433 1.093 . . . . 0.0 111.777 -176.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.738 0.304 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -95.79 -57.06 2.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.475 1.11 . . . . 0.0 113.456 -169.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.1 tpt -90.8 -100.24 0.11 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.403 0.681 . . . . 0.0 110.82 -171.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -76.06 -22.78 55.29 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 -169.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 58.6 m -59.6 -55.57 32.82 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.372 1.069 . . . . 0.0 110.686 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -67.88 -34.55 76.89 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -61.09 -47.86 84.35 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.929 0.492 . . . . 0.0 109.865 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.34 -41.49 96.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 118.495 -0.765 . . . . 0.0 111.393 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.18 -52.02 64.67 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.083 0.856 . . . . 0.0 110.341 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -55.46 -57.45 11.85 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.613 1.165 . . . . 0.0 110.696 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -54.18 -51.55 64.0 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.175 0.59 . . . . 0.0 111.102 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.55 -46.87 85.94 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.692 0.797 . . . . 0.0 111.649 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.27 -43.49 67.49 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.747 1.219 . . . . 0.0 111.47 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -89.54 -19.24 25.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.18 0.592 . . . . 0.0 112.31 -175.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.33 120.01 44.32 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 123.535 0.734 . . . . 0.0 110.783 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -81.17 -28.96 2.17 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.444 2.763 . . . . 0.0 111.955 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -55.89 -40.98 73.77 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.697 -174.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.0 mt -89.17 130.55 35.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 172.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -89.0 -178.82 5.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 178.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -41.4 -63.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.193 1.397 . . . . 0.0 113.528 -171.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.11 -44.65 91.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -64.85 -44.87 88.38 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.785 0.834 . . . . 0.0 110.645 -178.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -63.21 -47.61 81.8 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.483 1.513 . . . . 0.0 110.378 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -59.65 -42.34 92.55 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.382 0.673 . . . . 0.0 110.674 176.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.5 -38.05 85.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.623 0.369 . . . . 0.0 111.084 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -62.1 -49.98 73.77 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.673 0.789 . . . . 0.0 109.988 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 34.4 mm -53.62 -47.43 61.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.833 0.853 . . . . 0.0 110.221 174.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -56.93 -46.27 82.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.874 0.87 . . . . 0.0 110.927 178.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.0 m -60.81 -41.3 95.43 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.626 0.77 . . . . 0.0 111.779 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 46.8 mt -63.23 -52.11 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 118.15 0.432 . . . . 0.0 110.284 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -67.99 -33.79 75.3 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.12 -51.63 68.77 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.361 0.664 . . . . 0.0 110.496 172.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -56.98 -51.28 69.83 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.961 1.304 . . . . 0.0 111.094 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.67 -44.42 86.33 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.369 1.067 . . . . 0.0 111.769 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.163 0 O-C-N 122.193 -0.317 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.67 173.39 3.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.514 1.126 . . . . 0.0 111.06 174.789 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.44 166.32 3.15 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.15 0.58 . . . . 0.0 111.628 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.4 -59.89 0.51 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.966 2.106 . . . . 0.0 110.659 -171.383 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.2 m -54.9 -54.3 44.39 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.636 0.774 . . . . 0.0 109.165 170.018 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -53.4 -41.46 65.99 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.371 1.068 . . . . 0.0 111.593 177.281 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -64.34 -49.1 73.03 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 122.674 0.39 . . . . 0.0 110.762 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -57.88 -47.08 83.79 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.037 177.997 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -55.7 -57.87 10.19 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.946 0.498 . . . . 0.0 110.91 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -50.37 -58.79 4.9 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.425 1.49 . . . . 0.0 111.19 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.75 -51.28 69.47 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.548 0.739 . . . . 0.0 110.899 -178.798 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.39 -41.54 72.8 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.401 0.68 . . . . 0.0 112.002 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -57.26 -48.26 79.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.273 1.029 . . . . 0.0 110.46 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -89.09 -23.88 22.41 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -169.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.59 123.24 70.04 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 118.525 0.602 . . . . 0.0 111.002 -172.628 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.13 -30.89 6.5 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.436 2.757 . . . . 0.0 112.37 -174.775 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -63.09 -27.51 69.44 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.603 0.761 . . . . 0.0 111.345 -179.487 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 mp -88.94 125.68 35.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.581 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p-10 -88.9 -172.13 3.57 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.593 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.16 -42.22 65.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.997 0.519 . . . . 0.0 112.01 178.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.03 -60.85 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.675 0.79 . . . . 0.0 110.886 -176.821 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -60.32 -39.72 88.01 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.38 0.672 . . . . 0.0 110.536 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 ttp85 -58.69 -61.13 2.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.754 0.822 . . . . 0.0 110.263 177.802 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -61.01 -38.5 86.29 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 119.123 0.874 . . . . 0.0 111.439 -174.693 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -43.78 92.52 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.677 0.791 . . . . 0.0 111.347 174.607 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -49.23 69.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.495 0.718 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 31.0 mm -56.02 -40.81 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.95 0.9 . . . . 0.0 109.996 176.471 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -62.32 -48.33 80.32 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.517 0.727 . . . . 0.0 110.852 175.851 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 m -56.53 -48.74 76.61 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.089 0.556 . . . . 0.0 111.005 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.0 mt -64.67 -39.94 87.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.01 0.524 . . . . 0.0 109.982 -178.842 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -57.16 -41.3 78.92 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.962 0.801 . . . . 0.0 111.538 172.217 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -67.78 -43.77 78.99 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.078 0.399 . . . . 0.0 110.11 -178.896 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.4 -58.05 7.57 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.557 1.143 . . . . 0.0 111.237 -179.286 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.7 m -76.48 -41.01 48.63 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.729 1.212 . . . . 0.0 111.599 -173.29 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.07 0 O-C-N 122.039 -0.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -161.91 -174.02 3.96 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.886 1.274 . . . . 0.0 109.351 -179.345 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.4 ppp? -51.81 -36.65 48.7 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.355 1.062 . . . . 0.0 112.931 179.0 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -65.3 -44.66 87.22 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.963 0.505 . . . . 0.0 110.653 179.08 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.39 -42.44 96.13 Favored 'General case' 0 C--N 1.338 0.08 0 C-N-CA 123.438 0.695 . . . . 0.0 110.666 177.936 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -57.78 -48.54 79.38 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.685 0.794 . . . . 0.0 110.569 175.778 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -58.41 -46.41 86.49 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.023 0.929 . . . . 0.0 111.251 176.208 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 -59.77 -47.76 84.38 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.46 0.704 . . . . 0.0 111.119 179.357 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -58.03 -56.51 21.13 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 122.916 0.486 . . . . 0.0 110.468 176.596 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -50.44 -51.58 45.41 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.58 1.152 . . . . 0.0 110.9 -179.312 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -56.39 -57.95 10.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.782 0.833 . . . . 0.0 110.514 178.013 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.92 -44.65 74.43 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.093 0.957 . . . . 0.0 112.381 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.5 mt -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.066 0.947 . . . . 0.0 111.583 178.666 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -89.67 -23.15 21.94 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.242 0.617 . . . . 0.0 112.284 -172.008 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -60.79 126.4 85.3 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 124.194 0.997 . . . . 0.0 109.828 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.16 -129.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.1 2.533 . . . . 0.0 106.428 170.799 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.1 m120 70.42 -55.76 0.61 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.45 1.9 . . . . 0.0 113.472 175.361 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.3 mt -88.85 166.42 14.0 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.104 1.762 . . . . 0.0 109.193 -177.016 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -89.6 -177.8 5.39 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.039 0.536 . . . . 0.0 109.566 171.448 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -60.56 -55.32 34.82 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.072 0.949 . . . . 0.0 110.853 -175.554 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -58.8 -49.05 79.14 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.942 0.897 . . . . 0.0 111.34 -176.65 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.88 -46.12 90.33 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.984 0.514 . . . . 0.0 111.232 178.526 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.8 ttp-105 -64.31 -50.69 66.83 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.955 0.502 . . . . 0.0 111.645 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -63.93 -39.05 93.26 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 118.708 0.685 . . . . 0.0 111.57 179.325 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.62 -38.16 69.13 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.976 0.51 . . . . 0.0 110.987 171.728 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.12 -45.62 92.68 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.468 0.707 . . . . 0.0 110.366 174.904 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.6 mm -56.64 -48.53 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 122.966 0.506 . . . . 0.0 110.221 175.727 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -56.62 -46.18 81.08 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.001 0.52 . . . . 0.0 110.876 176.616 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -58.06 -47.62 82.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.57 0.748 . . . . 0.0 111.623 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -58.54 -49.44 82.34 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 176.84 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -61.82 -41.23 97.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.672 0.789 . . . . 0.0 111.984 -176.419 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -63.89 -52.1 61.49 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.079 0.952 . . . . 0.0 110.396 176.779 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.86 -51.96 65.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.638 1.175 . . . . 0.0 111.443 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 97.8 m -75.65 -29.96 59.29 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.654 1.181 . . . . 0.0 112.234 -175.365 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.07 0 O-C-N 122.003 -0.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 119.593 -0.241 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -89.13 -175.23 4.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.598 0.759 . . . . 0.0 109.665 174.03 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.4 tpt -45.7 -47.14 15.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.183 1.393 . . . . 0.0 111.796 177.456 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -71.05 -63.85 1.02 Allowed 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.007 0.923 . . . . 0.0 110.374 -178.261 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 93.1 m -60.57 -38.55 84.93 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.246 1.018 . . . . 0.0 112.37 -170.212 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -51.39 -52.74 43.23 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.612 0.765 . . . . 0.0 110.221 173.7 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -67.58 -36.44 80.91 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.785 0.834 . . . . 0.0 111.443 -177.784 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -60.44 -52.85 63.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 175.507 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -57.98 -52.38 65.77 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.224 0.609 . . . . 0.0 110.973 178.516 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -55.24 -51.61 66.03 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.882 1.273 . . . . 0.0 111.074 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -57.35 -51.69 68.36 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.959 0.904 . . . . 0.0 110.642 178.014 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.52 -39.52 76.73 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.87 0.868 . . . . 0.0 111.89 179.668 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.21 70.55 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 175.618 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.561 0.744 . . . . 0.0 110.139 -176.472 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -129.84 77.07 77.44 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.366 1.067 . . . . 0.0 109.051 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -70.05 -14.78 35.59 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.441 2.761 . . . . 0.0 112.463 -179.395 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -59.46 -36.26 75.63 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 110.047 173.08 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.34 146.31 24.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.243 1.017 . . . . 0.0 108.279 172.659 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -88.65 179.93 6.16 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -47.77 -51.32 22.82 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.853 1.261 . . . . 0.0 111.754 -178.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.02 -59.28 5.68 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.361 1.064 . . . . 0.0 111.16 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -55.06 -43.19 73.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.36 1.064 . . . . 0.0 111.29 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.8 ttp180 -64.82 -50.62 65.98 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 111.101 -177.814 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -63.49 -40.14 96.3 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.977 0.808 . . . . 0.0 111.352 178.201 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.59 88.55 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.443 0.697 . . . . 0.0 110.942 175.711 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -63.02 -47.86 81.22 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.894 0.877 . . . . 0.0 110.588 177.387 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.1 mm -54.47 -47.46 70.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.146 0.578 . . . . 0.0 110.525 175.55 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -61.51 -43.51 98.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.568 0.747 . . . . 0.0 111.363 178.724 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.6 m -60.31 -49.24 78.37 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.214 0.606 . . . . 0.0 110.684 178.232 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.1 mt -57.04 -44.77 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 123.626 0.771 . . . . 0.0 109.38 175.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -64.0 -34.72 78.64 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.309 0.644 . . . . 0.0 111.953 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -68.41 -47.86 66.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.142 0.577 . . . . 0.0 109.855 176.602 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -59.1 -49.81 76.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.235 1.014 . . . . 0.0 111.146 178.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 84.3 m -72.97 -44.25 61.31 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.279 1.432 . . . . 0.0 111.407 -175.138 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.055 0 O-C-N 122.054 -0.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.642 0.258 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 p-10 -106.12 -166.69 1.22 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.148 1.379 . . . . 0.0 110.738 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.0 tpt -60.83 -40.84 94.3 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.777 0.831 . . . . 0.0 111.26 177.595 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.34 -42.02 97.99 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.849 0.46 . . . . 0.0 110.971 177.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 90.8 m -63.48 -44.28 94.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.032 0.533 . . . . 0.0 110.762 176.147 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -58.26 -49.8 75.83 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.879 0.472 . . . . 0.0 110.882 177.004 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -54.19 -51.82 63.16 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.336 1.055 . . . . 0.0 110.506 175.265 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -52.79 -48.89 66.54 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.914 1.285 . . . . 0.0 111.391 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -60.9 -53.21 60.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.519 0.328 . . . . 0.0 111.178 176.588 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -54.13 -58.84 5.83 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.994 0.918 . . . . 0.0 111.077 -176.407 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.41 -45.16 94.6 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.567 -176.813 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.99 92.05 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.266 0.484 . . . . 0.0 111.455 179.133 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.25 -46.18 79.73 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.743 1.217 . . . . 0.0 111.473 -178.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -89.2 -28.56 19.89 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.059 0.544 . . . . 0.0 111.808 -171.942 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.88 122.07 59.45 Favored Pre-proline 0 CA--C 1.532 0.277 0 C-N-CA 123.674 0.79 . . . . 0.0 110.175 177.095 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -80.94 -132.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.106 2.537 . . . . 0.0 106.106 169.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 70.55 -50.95 0.67 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.431 1.892 . . . . 0.0 113.073 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.1 mt -88.77 162.04 16.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.883 1.673 . . . . 0.0 108.554 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -90.07 178.64 6.14 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.928 0.394 . . . . 0.0 110.579 175.37 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.05 -41.09 82.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.925 0.89 . . . . 0.0 111.394 179.464 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.16 -58.06 10.32 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.35 0.66 . . . . 0.0 110.573 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -55.56 -49.94 71.36 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.828 1.251 . . . . 0.0 110.897 179.132 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 ttp-105 -67.42 -42.41 83.24 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.439 0.695 . . . . 0.0 112.137 -173.611 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -70.88 -39.18 72.98 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.937 0.789 . . . . 0.0 110.543 178.48 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.2 -40.26 89.47 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.631 0.773 . . . . 0.0 111.298 175.385 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -58.97 -51.98 67.73 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.67 0.788 . . . . 0.0 109.758 174.223 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mt -57.5 -40.74 76.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 118.202 0.455 . . . . 0.0 111.52 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -61.02 -42.98 99.5 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 176.914 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.6 m -64.02 -44.36 92.81 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.632 0.773 . . . . 0.0 111.014 178.24 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.6 mt -62.15 -49.23 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.2 mtp-105 -52.66 -50.1 63.9 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.97 0.908 . . . . 0.0 111.327 175.465 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -58.97 -50.51 73.79 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.525 0.73 . . . . 0.0 111.023 -178.703 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.64 -52.21 65.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.37 1.068 . . . . 0.0 111.508 -179.19 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 88.1 m -71.91 -30.52 65.45 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.238 1.415 . . . . 0.0 112.264 -173.786 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.077 0 O-C-N 122.141 -0.349 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 . . . . . 0 CA--C 1.53 0.184 0 N-CA-C 110.686 -0.116 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.9 m -66.24 -45.0 82.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.077 0.951 . . . . 0.0 110.041 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -54.85 -53.83 50.22 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.08 0.952 . . . . 0.0 110.52 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -60.62 -43.55 97.35 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.689 0.796 . . . . 0.0 111.389 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.4 mtp85 -60.6 -45.48 93.84 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.466 0.706 . . . . 0.0 111.206 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -59.19 -52.58 65.07 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.278 0.49 . . . . 0.0 110.296 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -53.85 -48.74 69.68 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.17 0.988 . . . . 0.0 111.096 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -59.15 -53.28 60.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.645 0.778 . . . . 0.0 110.786 176.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.25 77.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.252 1.021 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.42 -53.84 52.69 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.411 0.685 . . . . 0.0 109.708 173.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -89.99 59.72 4.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.612 0.765 . . . . 0.0 110.136 -174.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -133.21 81.33 56.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.698 0.799 . . . . 0.0 110.226 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -54.78 -29.03 60.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 124.541 3.494 . . . . 0.0 114.125 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -58.72 -32.74 69.47 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.86 0.864 . . . . 0.0 111.594 -178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.6 mt -89.47 153.34 20.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.65 0.78 . . . . 0.0 109.393 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -89.53 -177.65 5.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.35 -51.43 69.44 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.541 0.736 . . . . 0.0 111.431 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -61.04 -51.95 67.02 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.899 0.88 . . . . 0.0 110.383 -174.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.87 -50.85 69.5 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.692 1.197 . . . . 0.0 110.883 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -59.24 -51.4 70.13 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.896 0.878 . . . . 0.0 111.06 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -59.13 -40.09 84.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.093 0.557 . . . . 0.0 111.362 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.654 0.382 . . . . 0.0 111.086 174.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -62.89 -50.7 69.86 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 109.96 178.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.2 mm -53.92 -48.81 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.277 1.031 . . . . 0.0 109.978 175.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -58.0 -43.41 86.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.871 0.869 . . . . 0.0 111.093 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -61.89 -47.18 86.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.36 0.664 . . . . 0.0 111.286 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.2 mt -57.41 -50.76 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -62.1 -43.24 99.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.875 0.87 . . . . 0.0 111.723 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.14 -51.45 69.01 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.919 0.888 . . . . 0.0 110.604 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.99 -52.78 64.31 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.316 1.046 . . . . 0.0 111.392 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.2 m . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 124.6 1.16 . . . . 0.0 112.347 -175.343 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 tm0? . . . . . 0 N--CA 1.454 -0.247 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.8 m -59.54 -44.64 93.16 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.803 0.841 . . . . 0.0 109.57 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -49.92 -51.85 37.75 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.521 1.128 . . . . 0.0 111.265 173.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -65.03 -40.25 94.57 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.48 0.712 . . . . 0.0 110.893 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -61.4 -48.29 81.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.252 0.621 . . . . 0.0 110.881 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -57.13 -50.14 73.72 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.229 0.612 . . . . 0.0 110.744 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -57.12 -52.36 65.6 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.08 0.952 . . . . 0.0 110.882 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -55.68 -54.03 49.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.683 0.793 . . . . 0.0 110.751 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.6 -47.63 76.2 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.053 0.941 . . . . 0.0 111.354 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 tp -55.39 -39.25 69.92 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.538 1.135 . . . . 0.0 111.382 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -103.01 20.9 16.7 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.606 0.762 . . . . 0.0 111.987 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -80.16 119.64 77.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 118.697 0.681 . . . . 0.0 110.132 -176.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.18 -28.69 2.3 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.346 2.697 . . . . 0.0 112.128 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -60.87 -41.07 95.25 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.67 1.188 . . . . 0.0 112.076 -172.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.22 162.41 15.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.018 0.927 . . . . 0.0 110.086 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -89.85 -179.47 5.74 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.714 0.806 . . . . 0.0 108.983 169.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.94 -50.15 67.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -60.61 -55.48 32.79 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.045 0.538 . . . . 0.0 111.345 -173.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.02 -36.82 84.3 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.82 0.448 . . . . 0.0 111.36 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.2 ttp-105 -60.88 -49.26 78.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.932 0.493 . . . . 0.0 110.762 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -60.64 -39.39 88.1 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.176 0.59 . . . . 0.0 110.949 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.65 -38.68 88.63 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 117.962 0.347 . . . . 0.0 111.125 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -64.83 -49.81 69.14 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.794 0.838 . . . . 0.0 109.971 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.0 mm -52.84 -47.31 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.408 1.083 . . . . 0.0 110.178 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -59.44 -46.76 87.83 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.452 0.701 . . . . 0.0 110.833 178.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -59.01 -44.57 91.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 111.402 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.41 -47.91 86.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.2 ttm105 -60.34 -42.55 95.93 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.947 0.499 . . . . 0.0 111.888 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -61.98 -48.98 77.92 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.29 0.636 . . . . 0.0 110.461 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -60.51 -54.29 47.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.387 1.075 . . . . 0.0 111.407 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 96.9 m . . . . . 0 N--CA 1.455 -0.201 0 C-N-CA 124.562 1.145 . . . . 0.0 111.65 -173.343 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 CA--C 1.529 0.144 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.3 m -61.24 -43.9 98.12 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.21 1.004 . . . . 0.0 109.568 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.64 -44.66 96.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.887 0.875 . . . . 0.0 110.952 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -61.16 -46.93 88.51 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.966 0.906 . . . . 0.0 110.618 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -60.55 -46.05 91.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.689 1.196 . . . . 0.0 110.871 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -58.5 -52.95 63.49 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.738 0.415 . . . . 0.0 110.462 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -56.33 -48.25 77.12 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.08 0.952 . . . . 0.0 111.138 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.98 -59.02 5.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.099 0.96 . . . . 0.0 110.346 177.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -47.18 73.34 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.208 1.003 . . . . 0.0 111.716 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 43.4 tp -55.52 -29.28 58.59 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.381 1.472 . . . . 0.0 112.466 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -116.3 16.38 15.79 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.87 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -77.39 119.54 77.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-O 118.669 -0.682 . . . . 0.0 109.647 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.63 -37.18 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.986 2.457 . . . . 0.0 111.814 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -63.71 -38.76 92.31 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.304 1.042 . . . . 0.0 111.399 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -89.15 137.22 32.52 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -89.08 -173.34 4.02 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.55 0.74 . . . . 0.0 109.313 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.59 -42.83 79.37 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.864 0.465 . . . . 0.0 112.115 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.02 -57.01 12.13 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.683 0.793 . . . . 0.0 110.309 -177.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.75 -44.24 93.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.048 0.939 . . . . 0.0 110.924 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -55.36 -56.13 23.66 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.309 1.043 . . . . 0.0 110.109 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.67 -43.05 75.96 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.381 0.673 . . . . 0.0 111.255 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.51 -38.15 80.17 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.94 0.496 . . . . 0.0 111.416 174.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -66.13 -50.37 64.21 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.929 0.892 . . . . 0.0 110.534 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.0 mm -57.74 -41.12 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.093 0.557 . . . . 0.0 109.932 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -61.54 -46.19 90.97 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.261 0.624 . . . . 0.0 111.481 176.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.7 p -63.13 -42.03 99.42 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.172 0.442 . . . . 0.0 111.358 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 54.5 mt -63.79 -53.0 50.01 Favored 'Isoleucine or valine' 0 C--N 1.342 0.253 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -61.97 -38.79 89.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.277 0.49 . . . . 0.0 111.153 -175.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.77 -53.46 53.99 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.855 0.862 . . . . 0.0 110.805 175.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.6 -55.98 27.14 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.912 1.285 . . . . 0.0 111.408 -178.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.9 m . . . . . 0 N--CA 1.453 -0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 111.763 -175.154 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -60.19 -52.13 66.61 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.865 0.866 . . . . 0.0 110.328 175.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -51.05 -50.11 59.25 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.507 1.123 . . . . 0.0 111.389 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 51.7 ttm-85 -55.2 -51.65 65.87 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.576 1.151 . . . . 0.0 110.698 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.95 -42.25 97.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.049 0.54 . . . . 0.0 111.733 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -59.75 -51.4 69.93 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.509 0.595 . . . . 0.0 110.14 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -55.76 -48.66 74.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.308 1.043 . . . . 0.0 111.031 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.99 -55.33 34.09 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.568 0.747 . . . . 0.0 110.221 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.84 -48.13 78.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.377 1.071 . . . . 0.0 111.77 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.77 -41.21 61.45 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.763 0.825 . . . . 0.0 110.926 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -103.22 54.7 0.76 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.114 0.966 . . . . 0.0 109.992 -177.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -129.43 81.88 69.01 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 123.833 0.853 . . . . 0.0 110.166 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.17 -37.25 38.54 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 125.04 3.826 . . . . 0.0 114.281 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -56.64 -35.0 67.86 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.194 0.998 . . . . 0.0 111.884 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.5 mt -89.57 138.41 31.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -88.83 -177.04 5.41 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -51.96 -47.68 64.69 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -61.51 -60.4 3.76 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.422 0.689 . . . . 0.0 110.615 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -58.21 -44.8 88.33 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.517 0.727 . . . . 0.0 111.14 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -62.31 -50.7 70.6 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.954 0.902 . . . . 0.0 110.397 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.4 -41.35 84.73 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.878 0.471 . . . . 0.0 110.956 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.05 89.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.809 0.444 . . . . 0.0 111.174 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -62.83 -50.59 70.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.917 0.887 . . . . 0.0 110.016 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 32.7 mm -53.96 -49.56 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 123.848 0.859 . . . . 0.0 109.875 175.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -56.54 -47.23 79.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.518 0.727 . . . . 0.0 110.954 179.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -58.11 -47.82 82.09 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.637 0.775 . . . . 0.0 111.446 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 51.6 mt -58.33 -48.41 85.08 Favored 'Isoleucine or valine' 0 C--N 1.341 0.234 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -63.91 -34.54 78.18 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.441 0.696 . . . . 0.0 112.126 -175.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -66.88 -51.39 56.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.461 0.705 . . . . 0.0 109.9 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.05 -47.38 74.88 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.599 1.16 . . . . 0.0 111.391 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.8 m . . . . . 0 N--CA 1.454 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.787 -175.772 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 110.469 -0.197 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -61.68 -50.09 73.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.774 0.43 . . . . 0.0 111.292 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -36.07 80.1 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -62.75 -50.86 69.39 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.301 0.64 . . . . 0.0 109.618 176.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -58.57 -43.99 89.57 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.382 0.673 . . . . 0.0 111.242 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -55.38 -54.06 48.39 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 118.697 0.681 . . . . 0.0 110.283 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -54.03 -58.81 5.91 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.125 0.97 . . . . 0.0 111.384 -175.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.69 -40.03 95.84 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.23 99.1 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.216 0.607 . . . . 0.0 111.348 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -51.09 71.09 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -89.34 49.03 1.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.588 0.755 . . . . 0.0 110.494 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -117.88 98.95 52.01 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 124.417 1.087 . . . . 0.0 108.587 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.45 -23.97 14.53 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.09 2.526 . . . . 0.0 112.019 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -61.34 -37.01 81.74 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.899 0.879 . . . . 0.0 110.655 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.28 146.66 24.58 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.179 0.992 . . . . 0.0 108.761 177.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -89.32 -177.29 5.34 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -57.85 -46.07 85.34 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.065 0.946 . . . . 0.0 111.467 -176.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -57.94 -57.79 11.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.349 0.66 . . . . 0.0 110.276 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.47 -47.67 75.74 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.129 0.972 . . . . 0.0 110.929 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm105 -55.1 -57.57 11.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.768 1.227 . . . . 0.0 110.511 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -59.08 -39.37 81.95 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.943 0.497 . . . . 0.0 111.597 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.67 91.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.215 0.461 . . . . 0.0 111.244 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -65.23 -48.59 72.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.021 0.928 . . . . 0.0 109.87 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -55.68 -46.35 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.641 0.777 . . . . 0.0 110.143 175.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -58.13 -43.6 87.33 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.226 0.61 . . . . 0.0 111.021 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -60.4 -48.28 82.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.921 0.488 . . . . 0.0 111.192 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.74 -46.27 96.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 123.334 0.654 . . . . 0.0 110.179 178.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -62.75 -31.56 72.53 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.326 1.05 . . . . 0.0 111.509 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.23 -44.46 62.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.275 0.63 . . . . 0.0 109.925 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.81 -51.86 67.86 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.161 0.984 . . . . 0.0 110.661 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.19 0 C-N-CA 122.793 0.437 . . . . 0.0 110.803 176.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 . . . . . 0 CA--C 1.529 0.14 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.4 m -63.0 -44.0 97.23 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.857 0.463 . . . . 0.0 111.169 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.97 -55.97 19.53 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.36 1.064 . . . . 0.0 111.188 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -60.81 -45.35 94.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.872 0.869 . . . . 0.0 110.682 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -65.18 -37.12 86.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.765 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.36 -55.09 39.17 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.022 0.828 . . . . 0.0 109.659 174.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -52.26 -53.7 40.57 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.237 1.015 . . . . 0.0 110.517 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -54.25 -57.18 12.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.596 0.759 . . . . 0.0 110.804 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.1 -45.54 71.86 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.977 0.911 . . . . 0.0 111.912 -177.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.39 -47.13 63.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.828 1.251 . . . . 0.0 110.487 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -89.33 -19.81 24.82 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.599 0.76 . . . . 0.0 112.246 -173.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.74 117.85 24.18 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.421 1.089 . . . . 0.0 111.316 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -82.73 -24.66 3.33 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.557 2.838 . . . . 0.0 112.069 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -58.93 -38.72 79.62 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.474 1.11 . . . . 0.0 111.754 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -89.13 147.94 23.94 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -89.13 -179.74 5.96 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.628 0.771 . . . . 0.0 108.954 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.05 -48.64 61.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.516 0.726 . . . . 0.0 111.774 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -60.36 -58.63 7.7 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.91 0.884 . . . . 0.0 110.719 -175.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -66.32 -33.13 75.03 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.485 0.714 . . . . 0.0 111.834 -177.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -66.51 -48.7 68.94 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.844 0.857 . . . . 0.0 110.564 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.27 -39.49 94.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.153 0.433 . . . . 0.0 110.834 176.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.25 -42.98 96.47 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.72 0.408 . . . . 0.0 111.079 175.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.76 -50.95 71.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.084 0.954 . . . . 0.0 110.264 176.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.7 mm -52.28 -51.05 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.089 0.555 . . . . 0.0 110.003 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.7 -43.77 85.41 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.43 0.692 . . . . 0.0 111.527 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -59.13 -47.49 85.09 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.996 0.519 . . . . 0.0 110.751 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.6 mt -64.12 -42.55 95.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.422 0.689 . . . . 0.0 110.21 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -58.32 -39.31 79.07 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.004 0.521 . . . . 0.0 110.887 174.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.59 -41.39 72.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.552 0.741 . . . . 0.0 110.495 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -54.78 -57.07 13.02 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.455 1.102 . . . . 0.0 111.013 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 57.2 m . . . . . 0 C--N 1.34 0.168 0 CA-C-N 117.661 0.209 . . . . 0.0 111.043 179.26 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 111.339 0.126 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.0 m -62.35 -46.92 86.51 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.69 0.396 . . . . 0.0 109.95 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -60.49 -47.65 85.22 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 122.888 0.475 . . . . 0.0 111.413 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -55.21 -49.6 71.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.679 1.191 . . . . 0.0 110.616 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.21 -40.69 96.58 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.792 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -58.54 -52.74 64.38 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.909 0.777 . . . . 0.0 110.437 176.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -54.93 -52.4 63.07 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.54 1.136 . . . . 0.0 110.687 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.28 -55.82 27.08 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.54 0.736 . . . . 0.0 110.071 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.0 -46.43 71.74 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 111.561 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.02 -50.1 48.59 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.243 1.017 . . . . 0.0 109.966 177.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.01 3.08 54.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.935 0.894 . . . . 0.0 113.031 -175.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -73.21 122.06 86.69 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 119.008 0.822 . . . . 0.0 110.89 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -80.15 -28.47 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.256 2.637 . . . . 0.0 112.037 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -60.55 -47.07 87.82 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.185 0.994 . . . . 0.0 111.769 -171.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.9 mt -89.49 150.27 22.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.72 0.808 . . . . 0.0 109.541 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -89.46 -174.76 4.48 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.01 0.924 . . . . 0.0 109.274 175.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -51.39 -52.7 43.65 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.556 1.142 . . . . 0.0 111.911 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -65.69 -51.1 62.04 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.41 0.684 . . . . 0.0 111.054 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.75 -33.88 74.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.229 0.611 . . . . 0.0 111.251 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -61.2 -50.2 74.09 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.067 0.547 . . . . 0.0 109.794 172.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.43 -40.63 95.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.545 0.338 . . . . 0.0 111.006 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.14 -46.72 85.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.646 0.778 . . . . 0.0 110.856 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -59.07 -52.54 65.29 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.547 0.739 . . . . 0.0 110.113 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.0 mm -51.48 -58.17 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.84 0.856 . . . . 0.0 110.875 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.23 -35.7 81.69 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.7 p -63.89 -45.59 88.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.357 0.526 . . . . 0.0 110.668 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 39.8 mt -59.76 -48.04 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 119.013 -0.517 . . . . 0.0 109.635 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 41.3 mtm105 -57.89 -37.73 74.52 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.758 0.708 . . . . 0.0 111.934 177.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -67.05 -49.38 65.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.968 0.507 . . . . 0.0 109.868 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.27 -48.76 80.42 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.378 1.071 . . . . 0.0 111.131 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.3 m . . . . . 0 CA--C 1.53 0.184 0 C-N-CA 125.139 1.376 . . . . 0.0 111.813 -177.353 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 . . . . . 0 C--O 1.226 -0.148 0 N-CA-C 111.318 0.118 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.5 m -53.67 -37.95 63.68 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.741 1.216 . . . . 0.0 112.225 177.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -61.38 -45.21 95.31 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.77 -34.06 73.25 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.393 0.677 . . . . 0.0 110.785 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -63.29 -49.24 74.8 Favored 'General case' 0 C--N 1.341 0.224 0 C-N-CA 123.529 0.732 . . . . 0.0 110.135 173.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -59.14 -46.09 89.27 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.691 0.396 . . . . 0.0 111.151 176.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -57.31 -50.68 72.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.441 1.097 . . . . 0.0 110.681 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.91 -52.34 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.567 0.747 . . . . 0.0 110.686 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.67 -42.63 75.39 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.37 1.068 . . . . 0.0 111.597 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.55 -51.96 67.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.688 0.795 . . . . 0.0 110.005 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -91.57 62.98 4.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.777 0.831 . . . . 0.0 110.22 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -133.62 83.02 49.5 Favored Pre-proline 0 CA--C 1.536 0.44 0 C-N-CA 123.685 0.794 . . . . 0.0 109.47 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.38 -29.09 29.47 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 124.777 3.652 . . . . 0.0 114.798 -178.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -59.45 -29.68 67.97 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.794 0.838 . . . . 0.0 112.241 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.7 mt -89.51 165.1 14.5 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.338 0.655 . . . . 0.0 110.169 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.68 -165.58 1.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.215 1.006 . . . . 0.0 109.281 169.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -47.01 -75.81 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.293 1.437 . . . . 0.0 113.526 -170.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -60.51 -40.44 91.45 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -57.17 -52.83 63.75 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.943 0.897 . . . . 0.0 110.882 176.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.5 ttm-85 -61.06 -52.6 64.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.958 0.903 . . . . 0.0 110.313 -178.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -56.55 -42.56 78.76 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.908 0.483 . . . . 0.0 111.194 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.79 85.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.11 0.564 . . . . 0.0 111.436 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -62.12 -48.34 80.59 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.704 0.802 . . . . 0.0 109.841 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.88 -37.26 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.661 0.784 . . . . 0.0 110.297 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -61.73 -52.0 66.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.083 0.953 . . . . 0.0 110.327 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -59.15 -43.11 92.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.683 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.8 mt -60.58 -47.04 94.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 118.479 0.581 . . . . 0.0 109.931 176.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -55.13 -39.81 69.83 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 118.529 0.604 . . . . 0.0 111.904 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -67.64 -49.07 64.75 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 118.164 0.438 . . . . 0.0 110.14 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -60.36 -49.98 75.42 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.483 1.113 . . . . 0.0 111.248 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m . . . . . 0 N--CA 1.456 -0.155 0 C-N-CA 124.585 1.154 . . . . 0.0 111.472 -174.635 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 . . . . . 0 CA--C 1.532 0.266 0 CA-C-O 119.414 -0.326 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.12 -55.47 33.43 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.532 0.605 . . . . 0.0 109.787 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -60.9 -37.9 83.84 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.502 0.721 . . . . 0.0 111.904 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -61.06 -49.72 76.2 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.54 0.736 . . . . 0.0 109.987 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.56 -37.2 86.01 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.536 0.735 . . . . 0.0 111.523 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -58.85 -54.77 43.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.771 0.714 . . . . 0.0 110.248 174.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -55.86 -49.04 74.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.941 1.296 . . . . 0.0 111.066 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -55.69 -53.43 56.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.829 1.252 . . . . 0.0 110.802 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.61 87.43 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.339 1.056 . . . . 0.0 111.478 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.35 -48.18 74.62 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.491 0.717 . . . . 0.0 109.316 175.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -94.68 41.74 1.09 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.81 0.844 . . . . 0.0 111.17 -177.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -117.77 90.47 36.28 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.215 1.006 . . . . 0.0 108.523 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.74 -25.57 20.28 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.042 2.494 . . . . 0.0 112.01 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -60.3 -35.79 76.39 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.778 0.831 . . . . 0.0 110.972 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.2 mt -89.37 140.01 29.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -89.08 -175.4 4.8 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.405 0.682 . . . . 0.0 109.658 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -51.42 -50.0 60.53 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.938 0.895 . . . . 0.0 111.471 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.4 -54.37 37.77 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.209 0.604 . . . . 0.0 111.199 -174.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -59.76 -45.33 92.57 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.63 0.772 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -57.54 -56.53 20.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.003 0.921 . . . . 0.0 110.241 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.64 -42.38 88.15 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.581 . . . . 0.0 111.179 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.07 -48.16 82.59 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.973 0.509 . . . . 0.0 110.97 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.44 -50.49 73.52 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.927 0.891 . . . . 0.0 110.692 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.8 mm -51.74 -52.72 20.4 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.146 0.978 . . . . 0.0 110.025 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -56.57 -49.1 75.86 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.166 0.586 . . . . 0.0 111.468 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -54.26 -51.51 64.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.985 0.514 . . . . 0.0 111.219 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.6 mt -60.03 -45.52 95.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.226 0.611 . . . . 0.0 110.053 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -57.55 -39.61 77.03 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 123.22 0.608 . . . . 0.0 111.685 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -69.2 -46.16 68.14 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.752 0.421 . . . . 0.0 109.883 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -58.85 -49.89 76.04 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.285 1.034 . . . . 0.0 111.075 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.0 m . . . . . 0 CA--C 1.529 0.173 0 C-N-CA 124.572 1.149 . . . . 0.0 111.703 -176.541 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 . . . . . 0 CA--C 1.533 0.301 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -46.12 -45.79 16.69 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.341 1.457 . . . . 0.0 111.473 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.42 -49.22 75.15 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.84 0.856 . . . . 0.0 111.622 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.94 -42.4 90.09 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.151 0.98 . . . . 0.0 109.604 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -60.85 -44.93 96.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.352 1.061 . . . . 0.0 110.983 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -60.39 -50.42 73.66 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.253 0.621 . . . . 0.0 110.344 176.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -54.84 -51.49 65.73 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.932 0.893 . . . . 0.0 110.805 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -56.0 -54.48 44.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.757 0.823 . . . . 0.0 110.41 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.06 -40.68 73.93 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.391 1.076 . . . . 0.0 111.831 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -52.18 66.78 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -89.8 51.47 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.956 0.902 . . . . 0.0 110.358 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -119.38 81.32 22.51 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.283 1.033 . . . . 0.0 109.458 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.2 -20.3 24.91 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.203 2.602 . . . . 0.0 111.886 177.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -60.86 -37.01 80.63 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.851 0.861 . . . . 0.0 110.866 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -89.28 159.3 17.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.493 0.717 . . . . 0.0 109.413 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 -89.54 175.08 7.43 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.763 0.825 . . . . 0.0 108.81 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.38 -33.2 72.12 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.86 -63.2 1.38 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.806 0.843 . . . . 0.0 110.898 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.42 -35.47 81.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.805 0.442 . . . . 0.0 110.885 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.2 ttp-105 -61.2 -52.55 64.32 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.071 0.549 . . . . 0.0 111.108 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -63.88 -38.35 90.77 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.731 0.696 . . . . 0.0 110.946 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -42.96 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.752 0.421 . . . . 0.0 110.821 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -61.07 -48.85 79.82 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.71 0.804 . . . . 0.0 110.387 177.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.1 -49.64 60.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 123.426 0.691 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -58.18 -42.67 86.59 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.739 0.816 . . . . 0.0 111.253 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -59.68 -48.63 80.91 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 122.865 0.466 . . . . 0.0 111.263 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.15 -46.93 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 118.268 0.485 . . . . 0.0 109.971 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -61.31 -33.81 74.21 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.593 0.757 . . . . 0.0 111.815 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -70.83 -44.94 65.44 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.172 0.589 . . . . 0.0 110.143 175.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -58.47 -52.6 64.95 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.423 1.089 . . . . 0.0 110.716 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 122.818 0.447 . . . . 0.0 110.834 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.446 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 13.1 pt20 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.5 m -68.93 -37.67 79.05 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 171.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -58.84 -42.63 89.74 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.835 0.454 . . . . 0.0 110.676 171.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 90.7 mtt-85 -63.25 -42.57 99.2 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.978 0.511 . . . . 0.0 110.416 177.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 9' ' ' GLN . 28.5 mmm180 -56.97 -51.12 70.49 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.052 0.541 . . . . 0.0 110.884 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -57.0 -52.62 64.56 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 122.571 0.348 . . . . 0.0 110.843 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -51.3 -59.73 3.9 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.349 1.06 . . . . 0.0 110.81 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -54.75 -48.42 72.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.759 0.824 . . . . 0.0 111.243 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.09 -45.95 86.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.748 0.819 . . . . 0.0 112.212 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.5 mt -59.77 -39.91 86.47 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.081 0.952 . . . . 0.0 111.942 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -89.2 -36.84 15.42 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.882 0.473 . . . . 0.0 111.543 -172.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.36 134.18 95.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.6 -126.48 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.945 2.43 . . . . 0.0 107.581 174.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 55.85 17.72 2.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.746 1.218 . . . . 0.0 113.289 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.3 mt -150.03 134.03 17.0 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.43 1.492 . . . . 0.0 107.64 -170.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.1 p30 -89.79 -176.36 4.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 169.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.79 -52.47 65.33 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.039 0.536 . . . . 0.0 111.195 -177.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -61.27 -53.33 58.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.289 0.636 . . . . 0.0 110.971 -174.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -62.39 -42.55 99.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.5 ttp85 -56.32 -61.46 2.39 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.013 0.525 . . . . 0.0 110.171 176.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -60.14 -35.87 76.24 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.251 -0.404 . . . . 0.0 111.986 -176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.69 -43.12 99.63 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.048 0.539 . . . . 0.0 111.295 175.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -69.64 -45.26 68.87 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 110.162 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.7 mm -54.47 -48.12 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.045 0.938 . . . . 0.0 110.017 172.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -58.14 -45.41 87.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.836 0.854 . . . . 0.0 110.911 177.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -57.68 -48.4 79.65 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.939 0.496 . . . . 0.0 111.057 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -57.96 -52.63 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.136 0.574 . . . . 0.0 109.64 176.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -57.28 -43.36 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.152 0.981 . . . . 0.0 112.065 -177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.04 -47.86 73.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.391 0.677 . . . . 0.0 110.319 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -51.97 67.61 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.024 0.93 . . . . 0.0 111.374 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 CA--C 1.529 0.168 0 C-N-CA 124.805 1.242 . . . . 0.0 111.282 -177.632 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 m -61.72 -35.3 77.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.585 0.629 . . . . 0.0 111.862 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -59.89 -55.27 36.23 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.388 0.54 . . . . 0.0 111.678 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.67 -30.62 71.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.427 0.558 . . . . 0.0 111.882 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -65.69 -43.11 90.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.205 0.602 . . . . 0.0 110.798 174.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -59.63 -50.86 72.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.916 0.78 . . . . 0.0 110.348 174.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -54.75 -49.8 69.96 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.291 1.037 . . . . 0.0 110.637 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -55.81 -54.03 49.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.895 0.878 . . . . 0.0 110.354 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.88 -47.0 71.51 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.19 0.996 . . . . 0.0 112.166 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.6 mt -53.59 -39.4 64.83 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.983 0.913 . . . . 0.0 112.182 177.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -98.92 -20.07 17.0 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.79 0.836 . . . . 0.0 113.166 -169.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.76 122.95 79.77 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.414 0.686 . . . . 0.0 110.493 -173.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.49 -29.31 11.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.479 2.786 . . . . 0.0 112.668 -173.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -63.53 -28.3 69.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.464 0.705 . . . . 0.0 111.203 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.4 mt -89.63 128.48 36.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -88.8 -165.97 1.48 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.16 -51.32 70.21 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.918 0.487 . . . . 0.0 111.001 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -58.24 -57.29 13.51 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.15 0.98 . . . . 0.0 110.598 -177.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -56.48 -41.98 77.49 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.148 1.379 . . . . 0.0 110.881 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.87 -55.22 28.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.346 0.658 . . . . 0.0 109.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -58.07 -41.21 82.9 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.819 0.736 . . . . 0.0 111.326 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.85 -44.4 94.14 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.802 0.441 . . . . 0.0 111.204 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.44 -50.43 72.83 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.14 0.976 . . . . 0.0 110.472 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.1 mm -52.69 -49.36 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.867 0.867 . . . . 0.0 110.084 175.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.5 -47.52 76.09 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.049 0.94 . . . . 0.0 110.94 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.5 m -60.76 -41.22 95.02 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.414 0.686 . . . . 0.0 112.027 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.5 mt -67.66 -49.62 68.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.496 -177.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -65.62 -36.48 83.85 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 118.202 0.455 . . . . 0.0 111.7 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.19 -46.22 90.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.086 0.555 . . . . 0.0 110.602 172.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -58.16 -57.22 13.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.455 1.102 . . . . 0.0 111.595 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.531 0.224 0 CA-C-N 117.914 0.325 . . . . 0.0 111.807 179.266 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.7 m -59.47 -43.86 93.16 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 124.082 0.953 . . . . 0.0 109.717 169.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -60.12 -43.79 95.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.125 0.57 . . . . 0.0 110.75 173.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -64.22 -37.6 88.07 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.187 0.595 . . . . 0.0 111.158 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -65.52 -46.38 79.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.119 0.968 . . . . 0.0 110.403 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.85 -54.79 42.94 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.285 0.493 . . . . 0.0 110.518 173.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -53.4 -48.4 68.72 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.777 1.631 . . . . 0.0 111.09 -177.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.09 -51.62 68.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.361 1.064 . . . . 0.0 110.782 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.98 -44.89 79.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.603 0.761 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -59.82 -52.71 64.28 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.823 0.849 . . . . 0.0 110.339 175.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -89.75 53.73 2.65 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.345 0.658 . . . . 0.0 110.501 -174.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -160.26 136.78 6.45 Favored Pre-proline 0 N--CA 1.453 -0.281 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -80.17 -129.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.845 2.363 . . . . 0.0 107.453 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 56.34 13.42 1.27 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.884 1.273 . . . . 0.0 113.429 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.5 mt -150.03 132.01 15.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.53 1.532 . . . . 0.0 107.392 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -89.8 -172.72 3.64 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -51.63 -52.56 46.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.374 0.669 . . . . 0.0 110.775 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -59.14 -56.83 17.1 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.701 0.8 . . . . 0.0 110.91 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -60.89 -40.46 93.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.898 0.879 . . . . 0.0 111.376 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.28 -57.3 13.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.569 0.748 . . . . 0.0 110.259 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -62.36 -35.7 79.95 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.256 -178.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.97 -43.76 98.16 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.049 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.22 -50.69 72.07 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.596 0.758 . . . . 0.0 110.299 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.17 -47.84 76.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 122.831 0.452 . . . . 0.0 110.106 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.9 tttp -58.42 -44.34 89.03 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.346 0.658 . . . . 0.0 111.247 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.4 m -61.68 -48.31 81.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.586 0.754 . . . . 0.0 111.084 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 49.8 mt -60.64 -47.63 92.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 123.587 0.755 . . . . 0.0 109.834 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 51.4 ttm-85 -64.21 -39.83 94.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.218 1.007 . . . . 0.0 111.674 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -65.0 -50.44 66.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.776 0.83 . . . . 0.0 110.355 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.76 -52.95 62.18 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.796 1.238 . . . . 0.0 111.216 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 94.9 m . . . . . 0 N--CA 1.455 -0.177 0 C-N-CA 124.123 0.969 . . . . 0.0 111.733 -177.669 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 119.623 -0.227 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.53 -45.56 86.66 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.93 0.492 . . . . 0.0 110.58 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -54.87 -54.46 42.18 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.689 0.796 . . . . 0.0 110.643 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.0 -42.71 80.79 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.88 1.272 . . . . 0.0 110.834 177.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.3 -51.32 70.43 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.135 0.974 . . . . 0.0 111.708 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -58.63 -52.47 65.55 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 118.068 0.395 . . . . 0.0 110.407 177.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -54.66 -51.3 65.9 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.186 0.994 . . . . 0.0 111.42 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.98 -53.38 59.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.618 1.167 . . . . 0.0 110.764 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -39.19 90.97 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.88 0.872 . . . . 0.0 112.117 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 mt -57.83 -52.0 67.29 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.042 0.537 . . . . 0.0 109.721 173.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.32 0.648 . . . . 0.0 110.139 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -126.03 92.86 45.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.689 1.195 . . . . 0.0 108.509 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -72.81 -28.21 13.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.051 2.5 . . . . 0.0 111.92 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -60.59 -33.01 72.09 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.974 0.91 . . . . 0.0 111.2 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.13 137.18 32.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -88.77 172.72 9.02 Favored 'General case' 0 C--N 1.338 0.085 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -50.92 -41.16 58.53 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.323 0.649 . . . . 0.0 112.524 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.36 -62.38 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.188 0.595 . . . . 0.0 110.93 -176.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -64.65 -37.57 88.01 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.233 0.613 . . . . 0.0 111.012 -176.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -59.83 -54.67 43.55 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.959 0.904 . . . . 0.0 110.619 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.99 -40.53 95.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.163 0.438 . . . . 0.0 110.94 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.06 91.02 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.048 0.539 . . . . 0.0 110.916 175.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -50.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.809 0.444 . . . . 0.0 110.237 178.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.2 mm -53.24 -46.25 56.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.177 0.991 . . . . 0.0 110.127 178.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.69 -46.99 87.4 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.586 0.754 . . . . 0.0 111.016 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.2 t -61.92 -47.96 82.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.437 0.695 . . . . 0.0 111.282 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.75 -45.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 124.329 1.052 . . . . 0.0 109.125 177.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -64.08 -40.86 97.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.896 0.878 . . . . 0.0 111.598 -178.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.96 -48.6 81.04 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.264 0.626 . . . . 0.0 110.417 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.07 -51.62 67.2 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.786 0.834 . . . . 0.0 111.514 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 93.7 m . . . . . 0 CA--C 1.531 0.212 0 C-N-CA 125.185 1.394 . . . . 0.0 112.157 -175.331 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -57.73 -43.48 85.33 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.02 0.928 . . . . 0.0 111.29 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -56.92 -50.97 70.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.718 0.807 . . . . 0.0 110.674 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -63.35 -38.64 91.94 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.749 0.82 . . . . 0.0 111.659 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.7 mtp180 -62.03 -48.27 81.01 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.902 0.881 . . . . 0.0 110.458 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.88 -49.94 75.02 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.111 0.564 . . . . 0.0 111.031 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -57.64 -49.44 76.46 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.128 0.971 . . . . 0.0 110.883 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -55.92 -56.36 21.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.949 0.9 . . . . 0.0 110.15 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -40.65 76.86 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.186 0.994 . . . . 0.0 111.873 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 tp -60.09 -49.48 77.46 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.658 0.783 . . . . 0.0 109.812 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -93.39 58.44 2.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.75 0.82 . . . . 0.0 109.928 -178.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -129.11 86.89 55.78 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.803 0.841 . . . . 0.0 110.564 -178.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.57 -26.36 78.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 124.036 3.157 . . . . 0.0 113.318 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -55.39 -45.12 76.64 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.963 1.305 . . . . 0.0 111.855 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.0 mt -89.28 163.64 15.28 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.575 0.75 . . . . 0.0 109.644 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -89.41 -175.53 4.76 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.573 0.749 . . . . 0.0 109.37 174.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.3 -54.87 30.3 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 111.029 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -56.28 -52.86 62.95 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.567 0.747 . . . . 0.0 110.634 -179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.7 mm100 -60.65 -41.32 94.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 111.981 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ttp-105 -64.44 -46.97 80.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.084 0.554 . . . . 0.0 110.873 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -61.52 -39.08 89.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.106 0.412 . . . . 0.0 110.88 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.87 -44.05 97.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.957 0.503 . . . . 0.0 110.859 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -58.93 -50.59 73.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 0.0 110.507 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.0 mm -53.73 -47.75 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.704 0.802 . . . . 0.0 110.17 175.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.08 -45.2 93.69 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.568 0.747 . . . . 0.0 111.328 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -60.75 -45.57 93.78 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.645 0.778 . . . . 0.0 111.197 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.63 -47.33 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 123.426 0.691 . . . . 0.0 109.638 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -62.26 -43.29 99.16 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.613 0.765 . . . . 0.0 111.853 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.8 -50.82 70.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.842 0.857 . . . . 0.0 110.571 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.82 -53.51 57.41 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.643 1.177 . . . . 0.0 111.282 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.6 m . . . . . 0 CA--C 1.531 0.233 0 C-N-CA 124.33 1.052 . . . . 0.0 112.293 -175.27 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 . . . . . 0 CA--C 1.53 0.21 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.84 -36.36 78.08 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.666 0.787 . . . . 0.0 111.732 -178.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.9 tm0? -56.0 -53.02 61.93 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.415 0.686 . . . . 0.0 109.995 170.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -59.16 -41.76 89.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.165 0.986 . . . . 0.0 111.395 179.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -61.48 -49.39 76.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.364 0.666 . . . . 0.0 111.009 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -56.23 -56.08 25.42 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.232 0.469 . . . . 0.0 110.391 176.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -53.33 -52.77 58.1 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.209 1.404 . . . . 0.0 110.917 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -54.73 -55.76 26.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.165 0.986 . . . . 0.0 110.292 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.81 -44.28 70.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.708 0.803 . . . . 0.0 111.853 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.56 -46.85 63.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.069 1.348 . . . . 0.0 110.679 178.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -89.73 -30.8 17.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.669 0.788 . . . . 0.0 112.782 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -57.01 110.79 2.66 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 111.926 -169.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.15 -22.44 22.47 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.055 2.503 . . . . 0.0 112.126 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -61.3 -27.61 68.6 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.19 0.596 . . . . 0.0 111.011 175.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -89.61 132.36 35.15 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 172.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.4 p30 -89.18 -174.18 4.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 171.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.56 -44.02 68.93 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.54 0.736 . . . . 0.0 112.672 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.57 -59.83 3.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.365 1.066 . . . . 0.0 109.954 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -52.87 -46.68 68.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.927 1.291 . . . . 0.0 110.63 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 ttp-105 -61.97 -57.13 12.88 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.329 1.052 . . . . 0.0 111.327 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -61.22 -41.38 96.76 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.277 0.944 . . . . 0.0 111.077 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.71 -46.56 81.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.419 0.688 . . . . 0.0 111.016 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.69 -48.48 81.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.094 0.958 . . . . 0.0 110.91 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.7 mm -55.06 -49.43 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 122.901 0.481 . . . . 0.0 110.0 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -59.85 -40.95 90.31 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.929 0.492 . . . . 0.0 111.87 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -60.74 -46.91 88.63 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.92 0.488 . . . . 0.0 110.821 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 33.1 mt -64.94 -41.19 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.642 0.777 . . . . 0.0 109.766 178.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -57.12 -48.3 79.0 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.15 0.98 . . . . 0.0 110.565 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -63.76 -57.45 9.92 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.528 0.731 . . . . 0.0 110.635 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -50.25 -56.06 12.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.482 1.513 . . . . 0.0 111.977 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.664 1.185 . . . . 0.0 113.069 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 110.435 -0.209 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.8 m -58.21 -45.02 88.39 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.032 0.533 . . . . 0.0 110.411 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -58.53 -48.49 80.67 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.665 0.786 . . . . 0.0 111.412 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -55.81 -48.51 75.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.263 1.025 . . . . 0.0 110.57 175.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.2 mtp180 -60.35 -47.15 87.3 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.178 0.591 . . . . 0.0 111.244 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -57.52 -51.14 70.67 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.495 0.718 . . . . 0.0 110.552 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -54.78 -58.96 5.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.386 1.074 . . . . 0.0 110.619 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -53.99 -51.11 64.98 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.53 0.732 . . . . 0.0 111.048 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.76 -49.1 76.27 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.618 0.767 . . . . 0.0 111.509 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.9 -43.14 65.96 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.67 1.188 . . . . 0.0 111.743 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -89.71 -22.64 22.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.441 0.696 . . . . 0.0 112.602 -174.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.95 114.64 6.74 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.241 1.016 . . . . 0.0 111.097 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -76.81 -28.42 6.33 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.094 2.529 . . . . 0.0 111.934 -177.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -56.09 -42.26 76.47 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 124.821 1.249 . . . . 0.0 112.126 -173.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.3 mt -89.26 139.4 30.53 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -88.77 -177.69 5.59 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.023 0.929 . . . . 0.0 108.916 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -46.99 -51.95 15.91 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.793 0.837 . . . . 0.0 112.056 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -63.14 -56.47 16.5 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.564 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -66.86 -43.29 83.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.287 0.635 . . . . 0.0 110.942 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -60.92 -49.46 77.37 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.832 0.853 . . . . 0.0 110.298 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -63.42 -41.67 98.7 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.804 0.842 . . . . 0.0 110.258 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.85 -38.3 75.42 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.569 0.347 . . . . 0.0 111.178 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -62.36 -46.98 86.23 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 110.065 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.7 mm -55.55 -48.23 77.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.084 0.554 . . . . 0.0 110.151 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -57.37 -42.07 81.38 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.75 0.42 . . . . 0.0 111.383 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 m -62.19 -44.08 97.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.235 0.614 . . . . 0.0 111.465 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.66 -45.82 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -60.99 -38.17 85.03 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.671 0.788 . . . . 0.0 111.645 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -66.01 -47.63 73.84 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.453 0.701 . . . . 0.0 110.381 174.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -58.08 -54.6 45.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.4 1.08 . . . . 0.0 111.307 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.207 0 C-N-CA 123.149 0.58 . . . . 0.0 111.553 176.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 110.591 -0.152 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.7 -51.74 67.61 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.77 0.428 . . . . 0.0 111.442 174.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -50.84 -55.9 14.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.597 1.159 . . . . 0.0 110.82 -178.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -55.82 -53.9 51.08 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.57 0.748 . . . . 0.0 111.091 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -59.9 -45.5 92.36 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.888 -176.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.1 -56.85 16.41 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.135 0.574 . . . . 0.0 110.281 176.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -49.63 -56.75 8.93 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -55.51 -51.11 68.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.998 0.919 . . . . 0.0 110.919 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.48 87.69 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.619 0.768 . . . . 0.0 112.227 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.5 mt -58.33 -44.67 88.78 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.009 0.924 . . . . 0.0 111.837 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -89.35 -43.61 10.79 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.874 0.47 . . . . 0.0 111.749 -170.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.84 136.27 90.15 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 109.744 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.54 -127.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.864 2.376 . . . . 0.0 107.717 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 54.72 15.62 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.787 1.235 . . . . 0.0 113.49 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.5 mt -150.0 133.18 16.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.431 1.493 . . . . 0.0 107.635 -170.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -89.41 170.79 10.23 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 170.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -48.43 -57.41 6.12 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.282 1.033 . . . . 0.0 112.302 -173.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -57.45 -48.61 78.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.576 0.75 . . . . 0.0 111.35 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -68.54 -35.08 76.94 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.678 0.791 . . . . 0.0 111.533 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -67.33 -48.27 68.04 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.162 0.437 . . . . 0.0 109.859 177.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -59.42 -39.87 84.9 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.615 0.366 . . . . 0.0 111.019 174.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.05 -39.97 94.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.972 0.509 . . . . 0.0 111.303 176.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.5 -50.74 71.49 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.449 0.7 . . . . 0.0 110.196 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.8 mm -55.01 -48.64 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 122.99 0.516 . . . . 0.0 110.388 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -58.71 -45.45 89.51 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.014 0.526 . . . . 0.0 111.197 178.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.5 t -59.24 -46.74 87.68 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.629 0.771 . . . . 0.0 111.023 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -49.3 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 123.983 0.913 . . . . 0.0 109.945 177.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -57.19 -39.45 75.41 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.876 1.271 . . . . 0.0 111.953 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.67 -45.82 67.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.118 0.567 . . . . 0.0 110.344 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.89 -51.46 67.5 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.56 1.144 . . . . 0.0 111.054 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.5 m . . . . . 0 CA--C 1.529 0.146 0 C-N-CA 123.338 0.655 . . . . 0.0 110.39 178.069 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.426 0.155 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 m -64.74 -49.11 72.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.349 0.66 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -61.13 -44.55 97.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.914 0.486 . . . . 0.0 111.217 179.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -55.17 -51.01 67.85 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.806 1.242 . . . . 0.0 110.56 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -66.46 -38.97 88.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.718 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -58.19 -56.61 19.88 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.848 0.749 . . . . 0.0 110.01 174.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -51.81 -50.74 60.23 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.34 1.456 . . . . 0.0 110.743 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -55.96 -55.17 35.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.739 0.816 . . . . 0.0 110.665 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.23 -39.62 75.91 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.988 0.915 . . . . 0.0 112.121 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.43 -47.71 78.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.79 1.236 . . . . 0.0 110.489 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -89.36 -30.59 18.29 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.484 0.714 . . . . 0.0 111.912 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.11 123.9 67.29 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 124.648 1.179 . . . . 0.0 109.684 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -79.96 -135.98 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.961 2.441 . . . . 0.0 106.151 170.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.6 m120 70.18 -52.24 0.64 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.183 1.793 . . . . 0.0 112.407 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -88.88 151.7 22.18 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 126.269 1.828 . . . . 0.0 108.552 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -89.47 -174.64 4.43 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 172.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -58.18 -46.46 85.71 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.795 0.838 . . . . 0.0 111.717 -175.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -64.57 -48.86 73.43 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.879 -176.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -67.5 -35.09 78.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.166 0.586 . . . . 0.0 111.51 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -61.06 -51.4 69.32 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 172.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -59.94 -37.06 78.41 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.992 0.517 . . . . 0.0 111.122 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.29 97.84 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.402 0.681 . . . . 0.0 110.948 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -59.57 -52.09 67.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.466 0.707 . . . . 0.0 110.253 176.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.6 mm -52.96 -51.09 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.109 0.564 . . . . 0.0 109.98 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -57.33 -46.07 83.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.535 1.134 . . . . 0.0 111.656 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 p -64.41 -38.14 89.98 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.136 0.426 . . . . 0.0 111.672 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.69 -45.34 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.16 -40.91 82.62 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.557 0.743 . . . . 0.0 111.097 176.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.87 -51.18 63.39 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.515 0.726 . . . . 0.0 110.582 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.69 -50.32 66.12 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.076 1.351 . . . . 0.0 111.272 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.1 m . . . . . 0 N--CA 1.454 -0.248 0 C-N-CA 124.433 1.093 . . . . 0.0 111.777 -176.183 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 58.6 m -59.6 -55.57 32.82 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.372 1.069 . . . . 0.0 110.686 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -67.88 -34.55 76.89 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -61.09 -47.86 84.35 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.929 0.492 . . . . 0.0 109.865 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.34 -41.49 96.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 118.495 -0.765 . . . . 0.0 111.393 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.18 -52.02 64.67 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.083 0.856 . . . . 0.0 110.341 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -55.46 -57.45 11.85 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.613 1.165 . . . . 0.0 110.696 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -54.18 -51.55 64.0 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.175 0.59 . . . . 0.0 111.102 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.55 -46.87 85.94 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.692 0.797 . . . . 0.0 111.649 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.27 -43.49 67.49 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.747 1.219 . . . . 0.0 111.47 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -89.54 -19.24 25.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.18 0.592 . . . . 0.0 112.31 -175.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.33 120.01 44.32 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 123.535 0.734 . . . . 0.0 110.783 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -81.17 -28.96 2.17 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.444 2.763 . . . . 0.0 111.955 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -55.89 -40.98 73.77 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.697 -174.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.0 mt -89.17 130.55 35.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 172.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -89.0 -178.82 5.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 178.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -41.4 -63.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.193 1.397 . . . . 0.0 113.528 -171.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.11 -44.65 91.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -64.85 -44.87 88.38 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.785 0.834 . . . . 0.0 110.645 -178.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -63.21 -47.61 81.8 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.483 1.513 . . . . 0.0 110.378 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -59.65 -42.34 92.55 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.382 0.673 . . . . 0.0 110.674 176.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.5 -38.05 85.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.623 0.369 . . . . 0.0 111.084 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -62.1 -49.98 73.77 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.673 0.789 . . . . 0.0 109.988 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 34.4 mm -53.62 -47.43 61.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.833 0.853 . . . . 0.0 110.221 174.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -56.93 -46.27 82.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.874 0.87 . . . . 0.0 110.927 178.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.0 m -60.81 -41.3 95.43 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.626 0.77 . . . . 0.0 111.779 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 46.8 mt -63.23 -52.11 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 118.15 0.432 . . . . 0.0 110.284 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -67.99 -33.79 75.3 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.12 -51.63 68.77 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.361 0.664 . . . . 0.0 110.496 172.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -56.98 -51.28 69.83 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.961 1.304 . . . . 0.0 111.094 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.6 m . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.369 1.067 . . . . 0.0 111.769 -178.349 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 . . . . . 0 CA--C 1.532 0.271 0 CA-C-O 119.776 -0.154 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.2 m -54.9 -54.3 44.39 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.636 0.774 . . . . 0.0 109.165 170.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -53.4 -41.46 65.99 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.371 1.068 . . . . 0.0 111.593 177.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -64.34 -49.1 73.03 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 122.674 0.39 . . . . 0.0 110.762 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -57.88 -47.08 83.79 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.037 177.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -55.7 -57.87 10.19 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.946 0.498 . . . . 0.0 110.91 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -50.37 -58.79 4.9 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.425 1.49 . . . . 0.0 111.19 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.75 -51.28 69.47 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.548 0.739 . . . . 0.0 110.899 -178.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.39 -41.54 72.8 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.401 0.68 . . . . 0.0 112.002 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -57.26 -48.26 79.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.273 1.029 . . . . 0.0 110.46 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -89.09 -23.88 22.41 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -169.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.59 123.24 70.04 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 118.525 0.602 . . . . 0.0 111.002 -172.628 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.13 -30.89 6.5 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.436 2.757 . . . . 0.0 112.37 -174.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -63.09 -27.51 69.44 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.603 0.761 . . . . 0.0 111.345 -179.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 mp -88.94 125.68 35.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.581 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p-10 -88.9 -172.13 3.57 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.593 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.16 -42.22 65.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.997 0.519 . . . . 0.0 112.01 178.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.03 -60.85 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.675 0.79 . . . . 0.0 110.886 -176.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -60.32 -39.72 88.01 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.38 0.672 . . . . 0.0 110.536 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 ttp85 -58.69 -61.13 2.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.754 0.822 . . . . 0.0 110.263 177.802 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -61.01 -38.5 86.29 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 119.123 0.874 . . . . 0.0 111.439 -174.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -43.78 92.52 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.677 0.791 . . . . 0.0 111.347 174.607 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -49.23 69.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.495 0.718 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 31.0 mm -56.02 -40.81 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.95 0.9 . . . . 0.0 109.996 176.471 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -62.32 -48.33 80.32 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.517 0.727 . . . . 0.0 110.852 175.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 m -56.53 -48.74 76.61 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.089 0.556 . . . . 0.0 111.005 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.0 mt -64.67 -39.94 87.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.01 0.524 . . . . 0.0 109.982 -178.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -57.16 -41.3 78.92 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.962 0.801 . . . . 0.0 111.538 172.217 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -67.78 -43.77 78.99 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.078 0.399 . . . . 0.0 110.11 -178.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.4 -58.05 7.57 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.557 1.143 . . . . 0.0 111.237 -179.286 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.7 m . . . . . 0 CA--C 1.53 0.175 0 C-N-CA 124.729 1.212 . . . . 0.0 111.599 -173.29 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 . . . . . 0 CA--C 1.53 0.207 0 N-CA-C 110.653 -0.128 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.39 -42.44 96.13 Favored 'General case' 0 C--N 1.338 0.08 0 C-N-CA 123.438 0.695 . . . . 0.0 110.666 177.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -57.78 -48.54 79.38 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.685 0.794 . . . . 0.0 110.569 175.778 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -58.41 -46.41 86.49 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.023 0.929 . . . . 0.0 111.251 176.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 -59.77 -47.76 84.38 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.46 0.704 . . . . 0.0 111.119 179.357 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -58.03 -56.51 21.13 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 122.916 0.486 . . . . 0.0 110.468 176.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -50.44 -51.58 45.41 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.58 1.152 . . . . 0.0 110.9 -179.312 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -56.39 -57.95 10.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.782 0.833 . . . . 0.0 110.514 178.013 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.92 -44.65 74.43 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.093 0.957 . . . . 0.0 112.381 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.5 mt -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.066 0.947 . . . . 0.0 111.583 178.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -89.67 -23.15 21.94 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.242 0.617 . . . . 0.0 112.284 -172.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -60.79 126.4 85.3 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 124.194 0.997 . . . . 0.0 109.828 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.16 -129.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.1 2.533 . . . . 0.0 106.428 170.799 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.1 m120 70.42 -55.76 0.61 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.45 1.9 . . . . 0.0 113.472 175.361 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.3 mt -88.85 166.42 14.0 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.104 1.762 . . . . 0.0 109.193 -177.016 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -89.6 -177.8 5.39 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.039 0.536 . . . . 0.0 109.566 171.448 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -60.56 -55.32 34.82 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.072 0.949 . . . . 0.0 110.853 -175.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -58.8 -49.05 79.14 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.942 0.897 . . . . 0.0 111.34 -176.65 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.88 -46.12 90.33 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.984 0.514 . . . . 0.0 111.232 178.526 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.8 ttp-105 -64.31 -50.69 66.83 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.955 0.502 . . . . 0.0 111.645 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -63.93 -39.05 93.26 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 118.708 0.685 . . . . 0.0 111.57 179.325 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.62 -38.16 69.13 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.976 0.51 . . . . 0.0 110.987 171.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.12 -45.62 92.68 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.468 0.707 . . . . 0.0 110.366 174.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.6 mm -56.64 -48.53 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 122.966 0.506 . . . . 0.0 110.221 175.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -56.62 -46.18 81.08 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.001 0.52 . . . . 0.0 110.876 176.616 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -58.06 -47.62 82.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.57 0.748 . . . . 0.0 111.623 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -58.54 -49.44 82.34 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 176.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -61.82 -41.23 97.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.672 0.789 . . . . 0.0 111.984 -176.419 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -63.89 -52.1 61.49 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.079 0.952 . . . . 0.0 110.396 176.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.86 -51.96 65.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.638 1.175 . . . . 0.0 111.443 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 97.8 m . . . . . 0 CA--C 1.53 0.182 0 C-N-CA 124.654 1.181 . . . . 0.0 112.234 -175.365 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 93.1 m -60.57 -38.55 84.93 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.246 1.018 . . . . 0.0 112.37 -170.212 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -51.39 -52.74 43.23 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.612 0.765 . . . . 0.0 110.221 173.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -67.58 -36.44 80.91 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.785 0.834 . . . . 0.0 111.443 -177.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -60.44 -52.85 63.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 175.507 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -57.98 -52.38 65.77 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.224 0.609 . . . . 0.0 110.973 178.516 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -55.24 -51.61 66.03 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.882 1.273 . . . . 0.0 111.074 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -57.35 -51.69 68.36 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.959 0.904 . . . . 0.0 110.642 178.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.52 -39.52 76.73 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.87 0.868 . . . . 0.0 111.89 179.668 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.21 70.55 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 175.618 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.561 0.744 . . . . 0.0 110.139 -176.472 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -129.84 77.07 77.44 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.366 1.067 . . . . 0.0 109.051 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -70.05 -14.78 35.59 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.441 2.761 . . . . 0.0 112.463 -179.395 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -59.46 -36.26 75.63 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 110.047 173.08 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.34 146.31 24.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.243 1.017 . . . . 0.0 108.279 172.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -88.65 179.93 6.16 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -47.77 -51.32 22.82 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.853 1.261 . . . . 0.0 111.754 -178.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.02 -59.28 5.68 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.361 1.064 . . . . 0.0 111.16 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -55.06 -43.19 73.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.36 1.064 . . . . 0.0 111.29 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.8 ttp180 -64.82 -50.62 65.98 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 111.101 -177.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -63.49 -40.14 96.3 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.977 0.808 . . . . 0.0 111.352 178.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.59 88.55 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.443 0.697 . . . . 0.0 110.942 175.711 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -63.02 -47.86 81.22 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.894 0.877 . . . . 0.0 110.588 177.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.1 mm -54.47 -47.46 70.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.146 0.578 . . . . 0.0 110.525 175.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -61.51 -43.51 98.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.568 0.747 . . . . 0.0 111.363 178.724 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.6 m -60.31 -49.24 78.37 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.214 0.606 . . . . 0.0 110.684 178.232 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.1 mt -57.04 -44.77 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 123.626 0.771 . . . . 0.0 109.38 175.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -64.0 -34.72 78.64 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.309 0.644 . . . . 0.0 111.953 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -68.41 -47.86 66.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.142 0.577 . . . . 0.0 109.855 176.602 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -59.1 -49.81 76.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.235 1.014 . . . . 0.0 111.146 178.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 84.3 m . . . . . 0 N--CA 1.455 -0.212 0 C-N-CA 125.279 1.432 . . . . 0.0 111.407 -175.138 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 119.772 -0.156 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 90.8 m -63.48 -44.28 94.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.032 0.533 . . . . 0.0 110.762 176.147 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -58.26 -49.8 75.83 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.879 0.472 . . . . 0.0 110.882 177.004 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -54.19 -51.82 63.16 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.336 1.055 . . . . 0.0 110.506 175.265 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -52.79 -48.89 66.54 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.914 1.285 . . . . 0.0 111.391 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -60.9 -53.21 60.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.519 0.328 . . . . 0.0 111.178 176.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -54.13 -58.84 5.83 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.994 0.918 . . . . 0.0 111.077 -176.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.41 -45.16 94.6 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.567 -176.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.99 92.05 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.266 0.484 . . . . 0.0 111.455 179.133 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.25 -46.18 79.73 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.743 1.217 . . . . 0.0 111.473 -178.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -89.2 -28.56 19.89 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.059 0.544 . . . . 0.0 111.808 -171.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.88 122.07 59.45 Favored Pre-proline 0 CA--C 1.532 0.277 0 C-N-CA 123.674 0.79 . . . . 0.0 110.175 177.095 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -80.94 -132.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.106 2.537 . . . . 0.0 106.106 169.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 70.55 -50.95 0.67 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.431 1.892 . . . . 0.0 113.073 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.1 mt -88.77 162.04 16.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.883 1.673 . . . . 0.0 108.554 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -90.07 178.64 6.14 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.928 0.394 . . . . 0.0 110.579 175.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.05 -41.09 82.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.925 0.89 . . . . 0.0 111.394 179.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.16 -58.06 10.32 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.35 0.66 . . . . 0.0 110.573 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -55.56 -49.94 71.36 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.828 1.251 . . . . 0.0 110.897 179.132 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 ttp-105 -67.42 -42.41 83.24 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.439 0.695 . . . . 0.0 112.137 -173.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -70.88 -39.18 72.98 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.937 0.789 . . . . 0.0 110.543 178.48 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.2 -40.26 89.47 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.631 0.773 . . . . 0.0 111.298 175.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -58.97 -51.98 67.73 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.67 0.788 . . . . 0.0 109.758 174.223 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mt -57.5 -40.74 76.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 118.202 0.455 . . . . 0.0 111.52 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -61.02 -42.98 99.5 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 176.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.6 m -64.02 -44.36 92.81 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.632 0.773 . . . . 0.0 111.014 178.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.6 mt -62.15 -49.23 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.2 mtp-105 -52.66 -50.1 63.9 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.97 0.908 . . . . 0.0 111.327 175.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -58.97 -50.51 73.79 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.525 0.73 . . . . 0.0 111.023 -178.703 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.64 -52.21 65.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.37 1.068 . . . . 0.0 111.508 -179.19 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 88.1 m . . . . . 0 N--CA 1.455 -0.191 0 C-N-CA 125.238 1.415 . . . . 0.0 112.264 -173.786 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 111.336 0.124 . . . . 0.0 111.336 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -159.85 -165.39 1.5 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.793 1.237 . . . . 0.0 109.464 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.7 mtt -52.18 -43.8 64.35 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.857 1.263 . . . . 0.0 112.305 -178.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -62.2 -42.79 99.61 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 117.993 0.361 . . . . 0.0 110.686 -178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 67.9 m -66.24 -45.0 82.17 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.077 0.951 . . . . 0.0 110.041 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -54.85 -53.83 50.22 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.08 0.952 . . . . 0.0 110.52 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -60.62 -43.55 97.35 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.689 0.796 . . . . 0.0 111.389 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.4 mtp85 -60.6 -45.48 93.84 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.466 0.706 . . . . 0.0 111.206 177.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -59.19 -52.58 65.07 Favored 'General case' 0 C--N 1.341 0.205 0 CA-C-N 118.278 0.49 . . . . 0.0 110.296 176.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -53.85 -48.74 69.68 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.17 0.988 . . . . 0.0 111.096 -178.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -59.15 -53.28 60.14 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.645 0.778 . . . . 0.0 110.786 176.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.77 -44.25 77.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.252 1.021 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.42 -53.84 52.69 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 123.411 0.685 . . . . 0.0 109.708 173.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -89.99 59.72 4.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.612 0.765 . . . . 0.0 110.136 -174.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -133.21 81.33 56.6 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 123.698 0.799 . . . . 0.0 110.226 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -54.78 -29.03 60.56 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 124.541 3.494 . . . . 0.0 114.125 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -58.72 -32.74 69.47 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.86 0.864 . . . . 0.0 111.594 -178.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.6 mt -89.47 153.34 20.89 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.65 0.78 . . . . 0.0 109.393 178.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -89.53 -177.65 5.37 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.35 -51.43 69.44 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.541 0.736 . . . . 0.0 111.431 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -61.04 -51.95 67.02 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.899 0.88 . . . . 0.0 110.383 -174.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.87 -50.85 69.5 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.692 1.197 . . . . 0.0 110.883 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttp-105 -59.24 -51.4 70.13 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.896 0.878 . . . . 0.0 111.06 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -59.13 -40.09 84.4 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.093 0.557 . . . . 0.0 111.362 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 122.654 0.382 . . . . 0.0 111.086 174.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -62.89 -50.7 69.86 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 109.96 178.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.2 mm -53.92 -48.81 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.277 1.031 . . . . 0.0 109.978 175.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -58.0 -43.41 86.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.871 0.869 . . . . 0.0 111.093 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -61.89 -47.18 86.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.36 0.664 . . . . 0.0 111.286 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.2 mt -57.41 -50.76 75.95 Favored 'Isoleucine or valine' 0 C--N 1.343 0.288 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -62.1 -43.24 99.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.875 0.87 . . . . 0.0 111.723 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -61.14 -51.45 69.01 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.919 0.888 . . . . 0.0 110.604 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.99 -52.78 64.31 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.316 1.046 . . . . 0.0 111.392 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.2 m -73.33 -28.85 62.29 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.6 1.16 . . . . 0.0 112.347 -175.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.039 0 CA-C-N 118.131 0.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 49.8 p-10 -74.68 171.61 13.6 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.604 0.761 . . . . 0.0 111.201 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.9 ptp -78.46 54.01 1.38 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.58 1.152 . . . . 0.0 111.358 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 tm0? -155.35 -57.65 0.1 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 125.925 1.69 . . . . 0.0 106.795 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.8 m -59.54 -44.64 93.16 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 123.803 0.841 . . . . 0.0 109.57 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -49.92 -51.85 37.75 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.521 1.128 . . . . 0.0 111.265 173.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -65.03 -40.25 94.57 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.48 0.712 . . . . 0.0 110.893 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -61.4 -48.29 81.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.252 0.621 . . . . 0.0 110.881 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -57.13 -50.14 73.72 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.229 0.612 . . . . 0.0 110.744 176.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -57.12 -52.36 65.6 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.08 0.952 . . . . 0.0 110.882 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -55.68 -54.03 49.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.683 0.793 . . . . 0.0 110.751 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.6 -47.63 76.2 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.053 0.941 . . . . 0.0 111.354 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.6 tp -55.39 -39.25 69.92 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.538 1.135 . . . . 0.0 111.382 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -103.01 20.9 16.7 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.606 0.762 . . . . 0.0 111.987 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -80.16 119.64 77.16 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-N 118.697 0.681 . . . . 0.0 110.132 -176.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.18 -28.69 2.3 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.346 2.697 . . . . 0.0 112.128 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -60.87 -41.07 95.25 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.67 1.188 . . . . 0.0 112.076 -172.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.22 162.41 15.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.018 0.927 . . . . 0.0 110.086 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -89.85 -179.47 5.74 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.714 0.806 . . . . 0.0 108.983 169.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.94 -50.15 67.1 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.425 0.69 . . . . 0.0 111.413 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -60.61 -55.48 32.79 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.045 0.538 . . . . 0.0 111.345 -173.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.02 -36.82 84.3 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.82 0.448 . . . . 0.0 111.36 -178.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.2 ttp-105 -60.88 -49.26 78.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.932 0.493 . . . . 0.0 110.762 176.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -60.64 -39.39 88.1 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.176 0.59 . . . . 0.0 110.949 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.65 -38.68 88.63 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 117.962 0.347 . . . . 0.0 111.125 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -64.83 -49.81 69.14 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.794 0.838 . . . . 0.0 109.971 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.0 mm -52.84 -47.31 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 124.408 1.083 . . . . 0.0 110.178 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -59.44 -46.76 87.83 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.452 0.701 . . . . 0.0 110.833 178.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.0 m -59.01 -44.57 91.71 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 111.402 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.41 -47.91 86.68 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.2 ttm105 -60.34 -42.55 95.93 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.947 0.499 . . . . 0.0 111.888 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -61.98 -48.98 77.92 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.29 0.636 . . . . 0.0 110.461 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -60.51 -54.29 47.26 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.387 1.075 . . . . 0.0 111.407 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 96.9 m -71.24 -43.94 66.29 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 124.562 1.145 . . . . 0.0 111.65 -173.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.081 0 O-C-N 122.013 -0.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -163.84 164.84 23.37 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.403 1.081 . . . . 0.0 109.759 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.1 mtt -74.71 72.21 1.98 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.427 1.491 . . . . 0.0 111.885 -169.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 179.44 -42.89 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 127.881 2.472 . . . . 0.0 107.842 176.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.3 m -61.24 -43.9 98.12 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.21 1.004 . . . . 0.0 109.568 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -60.64 -44.66 96.12 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.887 0.875 . . . . 0.0 110.952 175.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ttp85 -61.16 -46.93 88.51 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.966 0.906 . . . . 0.0 110.618 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -60.55 -46.05 91.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.689 1.196 . . . . 0.0 110.871 178.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -58.5 -52.95 63.49 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 122.738 0.415 . . . . 0.0 110.462 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -56.33 -48.25 77.12 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.08 0.952 . . . . 0.0 111.138 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.98 -59.02 5.19 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.099 0.96 . . . . 0.0 110.346 177.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.49 -47.18 73.34 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.208 1.003 . . . . 0.0 111.716 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 43.4 tp -55.52 -29.28 58.59 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.381 1.472 . . . . 0.0 112.466 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -116.3 16.38 15.79 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.87 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -77.39 119.54 77.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-O 118.669 -0.682 . . . . 0.0 109.647 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.63 -37.18 1.35 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.986 2.457 . . . . 0.0 111.814 -177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -63.71 -38.76 92.31 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 124.304 1.042 . . . . 0.0 111.399 -176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -89.15 137.22 32.52 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -89.08 -173.34 4.02 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.55 0.74 . . . . 0.0 109.313 179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.59 -42.83 79.37 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.864 0.465 . . . . 0.0 112.115 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.02 -57.01 12.13 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.683 0.793 . . . . 0.0 110.309 -177.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -59.75 -44.24 93.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.048 0.939 . . . . 0.0 110.924 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -55.36 -56.13 23.66 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.309 1.043 . . . . 0.0 110.109 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -55.67 -43.05 75.96 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.381 0.673 . . . . 0.0 111.255 -179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.51 -38.15 80.17 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.94 0.496 . . . . 0.0 111.416 174.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? -66.13 -50.37 64.21 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.929 0.892 . . . . 0.0 110.534 178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.0 mm -57.74 -41.12 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.093 0.557 . . . . 0.0 109.932 176.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -61.54 -46.19 90.97 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.261 0.624 . . . . 0.0 111.481 176.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.7 p -63.13 -42.03 99.42 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 118.172 0.442 . . . . 0.0 111.358 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 54.5 mt -63.79 -53.0 50.01 Favored 'Isoleucine or valine' 0 C--N 1.342 0.253 0 C-N-CA 122.812 0.445 . . . . 0.0 110.353 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -61.97 -38.79 89.86 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 118.277 0.49 . . . . 0.0 111.153 -175.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -62.77 -53.46 53.99 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.855 0.862 . . . . 0.0 110.805 175.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -56.6 -55.98 27.14 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.912 1.285 . . . . 0.0 111.408 -178.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 82.9 m -73.4 -36.81 66.08 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.446 1.098 . . . . 0.0 111.763 -175.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.082 0 O-C-N 122.101 -0.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.2 p30 -72.98 173.92 8.59 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.581 0.752 . . . . 0.0 112.514 -175.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 mmt -60.93 -34.71 75.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.369 1.068 . . . . 0.0 112.652 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -44.84 84.1 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.615 0.766 . . . . 0.0 109.745 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.5 m -60.19 -52.13 66.61 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.865 0.866 . . . . 0.0 110.328 175.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -51.05 -50.11 59.25 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 124.507 1.123 . . . . 0.0 111.389 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 51.7 ttm-85 -55.2 -51.65 65.87 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.576 1.151 . . . . 0.0 110.698 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.95 -42.25 97.36 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.049 0.54 . . . . 0.0 111.733 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -59.75 -51.4 69.93 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.509 0.595 . . . . 0.0 110.14 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -55.76 -48.66 74.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.308 1.043 . . . . 0.0 111.031 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -55.99 -55.33 34.09 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.568 0.747 . . . . 0.0 110.221 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.84 -48.13 78.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.377 1.071 . . . . 0.0 111.77 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.77 -41.21 61.45 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.763 0.825 . . . . 0.0 110.926 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -103.22 54.7 0.76 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.114 0.966 . . . . 0.0 109.992 -177.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -129.43 81.88 69.01 Favored Pre-proline 0 CA--C 1.537 0.444 0 C-N-CA 123.833 0.853 . . . . 0.0 110.166 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.17 -37.25 38.54 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 125.04 3.826 . . . . 0.0 114.281 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -56.64 -35.0 67.86 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.194 0.998 . . . . 0.0 111.884 -178.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.5 mt -89.57 138.41 31.49 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -88.83 -177.04 5.41 Favored 'General case' 0 C--N 1.339 0.142 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -51.96 -47.68 64.69 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -61.51 -60.4 3.76 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.422 0.689 . . . . 0.0 110.615 -177.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -58.21 -44.8 88.33 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.517 0.727 . . . . 0.0 111.14 -176.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -62.31 -50.7 70.6 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.954 0.902 . . . . 0.0 110.397 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.4 -41.35 84.73 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 122.878 0.471 . . . . 0.0 110.956 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.05 89.67 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.809 0.444 . . . . 0.0 111.174 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -62.83 -50.59 70.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.917 0.887 . . . . 0.0 110.016 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 32.7 mm -53.96 -49.56 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 123.848 0.859 . . . . 0.0 109.875 175.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -56.54 -47.23 79.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.518 0.727 . . . . 0.0 110.954 179.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -58.11 -47.82 82.09 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.637 0.775 . . . . 0.0 111.446 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 51.6 mt -58.33 -48.41 85.08 Favored 'Isoleucine or valine' 0 C--N 1.341 0.234 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -63.91 -34.54 78.18 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.441 0.696 . . . . 0.0 112.126 -175.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -66.88 -51.39 56.0 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.461 0.705 . . . . 0.0 109.9 174.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.05 -47.38 74.88 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.599 1.16 . . . . 0.0 111.391 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.8 m -77.2 -37.45 53.53 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.831 1.252 . . . . 0.0 111.787 -175.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.049 0 O-C-N 122.031 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.473 0.685 0 CA-C-O 120.011 -0.042 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 22.6 p30 -72.6 176.5 5.41 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.524 0.73 . . . . 0.0 111.919 -176.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 45.2 tpp -48.98 -51.74 28.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 125.544 1.537 . . . . 0.0 112.019 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -61.09 -47.2 87.39 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 122.75 0.42 . . . . 0.0 110.469 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -61.68 -50.09 73.89 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.774 0.43 . . . . 0.0 111.292 -178.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -36.07 80.1 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 61.9 ttm-85 -62.75 -50.86 69.39 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.301 0.64 . . . . 0.0 109.618 176.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -58.57 -43.99 89.57 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.382 0.673 . . . . 0.0 111.242 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -55.38 -54.06 48.39 Favored 'General case' 0 C--N 1.343 0.326 0 CA-C-N 118.697 0.681 . . . . 0.0 110.283 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -54.03 -58.81 5.91 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.125 0.97 . . . . 0.0 111.384 -175.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.69 -40.03 95.84 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -177.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.75 -41.23 99.1 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.216 0.607 . . . . 0.0 111.348 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -51.09 71.09 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -89.34 49.03 1.69 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.588 0.755 . . . . 0.0 110.494 -175.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -117.88 98.95 52.01 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 124.417 1.087 . . . . 0.0 108.587 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.45 -23.97 14.53 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.09 2.526 . . . . 0.0 112.019 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -61.34 -37.01 81.74 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 123.899 0.879 . . . . 0.0 110.655 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.3 mt -89.28 146.66 24.58 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 124.179 0.992 . . . . 0.0 108.761 177.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -89.32 -177.29 5.34 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 175.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.4 mp0 -57.85 -46.07 85.34 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.065 0.946 . . . . 0.0 111.467 -176.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -57.94 -57.79 11.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.349 0.66 . . . . 0.0 110.276 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -55.47 -47.67 75.74 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.129 0.972 . . . . 0.0 110.929 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm105 -55.1 -57.57 11.19 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.768 1.227 . . . . 0.0 110.511 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -59.08 -39.37 81.95 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 122.943 0.497 . . . . 0.0 111.597 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.67 91.92 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.215 0.461 . . . . 0.0 111.244 174.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 tmtm? -65.23 -48.59 72.81 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.021 0.928 . . . . 0.0 109.87 178.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -55.68 -46.35 79.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.641 0.777 . . . . 0.0 110.143 175.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -58.13 -43.6 87.33 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.226 0.61 . . . . 0.0 111.021 177.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 m -60.4 -48.28 82.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.921 0.488 . . . . 0.0 111.192 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.3 mt -60.74 -46.27 96.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 123.334 0.654 . . . . 0.0 110.179 178.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.4 ttp85 -62.75 -31.56 72.53 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.326 1.05 . . . . 0.0 111.509 178.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -72.23 -44.46 62.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.275 0.63 . . . . 0.0 109.925 175.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.81 -51.86 67.86 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.161 0.984 . . . . 0.0 110.661 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -50.52 64.42 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.793 0.437 . . . . 0.0 110.803 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.135 0 O-C-N 122.443 -0.16 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.7 p-10 -88.06 -178.01 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.615 0.766 . . . . 0.0 109.732 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 92.4 mmm -57.29 -38.81 74.53 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.341 0.656 . . . . 0.0 112.059 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.66 -57.72 10.9 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.706 0.402 . . . . 0.0 110.373 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.4 m -63.0 -44.0 97.23 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 122.857 0.463 . . . . 0.0 111.169 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.97 -55.97 19.53 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.36 1.064 . . . . 0.0 111.188 175.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 58.2 ttm-85 -60.81 -45.35 94.75 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.872 0.869 . . . . 0.0 110.682 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.3 mtm180 -65.18 -37.12 86.35 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.726 -0.654 . . . . 0.0 111.765 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -59.36 -55.09 39.17 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.022 0.828 . . . . 0.0 109.659 174.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -52.26 -53.7 40.57 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.237 1.015 . . . . 0.0 110.517 -179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -54.25 -57.18 12.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.596 0.759 . . . . 0.0 110.804 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.1 -45.54 71.86 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.977 0.911 . . . . 0.0 111.912 -177.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.39 -47.13 63.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.828 1.251 . . . . 0.0 110.487 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -89.33 -19.81 24.82 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.599 0.76 . . . . 0.0 112.246 -173.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.74 117.85 24.18 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 124.421 1.089 . . . . 0.0 111.316 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -82.73 -24.66 3.33 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.557 2.838 . . . . 0.0 112.069 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -58.93 -38.72 79.62 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 124.474 1.11 . . . . 0.0 111.754 -174.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.2 mt -89.13 147.94 23.94 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -89.13 -179.74 5.96 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.628 0.771 . . . . 0.0 108.954 175.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -51.05 -48.64 61.5 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.516 0.726 . . . . 0.0 111.774 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -60.36 -58.63 7.7 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.91 0.884 . . . . 0.0 110.719 -175.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -66.32 -33.13 75.03 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.485 0.714 . . . . 0.0 111.834 -177.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -66.51 -48.7 68.94 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.844 0.857 . . . . 0.0 110.564 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.27 -39.49 94.73 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.153 0.433 . . . . 0.0 110.834 176.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.25 -42.98 96.47 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.72 0.408 . . . . 0.0 111.079 175.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.76 -50.95 71.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.084 0.954 . . . . 0.0 110.264 176.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.7 mm -52.28 -51.05 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.089 0.555 . . . . 0.0 110.003 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.7 -43.77 85.41 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.43 0.692 . . . . 0.0 111.527 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.9 m -59.13 -47.49 85.09 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.996 0.519 . . . . 0.0 110.751 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 31.6 mt -64.12 -42.55 95.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 123.422 0.689 . . . . 0.0 110.21 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -58.32 -39.31 79.07 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.004 0.521 . . . . 0.0 110.887 174.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -70.59 -41.39 72.41 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.552 0.741 . . . . 0.0 110.495 -178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.6 m-20 -54.78 -57.07 13.02 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.455 1.102 . . . . 0.0 111.013 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 57.2 m -76.49 -52.0 10.66 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 117.661 0.209 . . . . 0.0 111.043 179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.089 0 O-C-N 122.018 -0.426 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.348 0.129 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -158.13 -174.83 5.01 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.322 1.049 . . . . 0.0 109.737 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -54.21 -43.44 70.78 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.798 1.239 . . . . 0.0 111.5 -178.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -59.49 -39.67 84.53 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.392 0.677 . . . . 0.0 111.339 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.0 m -62.35 -46.92 86.51 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.69 0.396 . . . . 0.0 109.95 175.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -60.49 -47.65 85.22 Favored 'General case' 0 C--N 1.342 0.245 0 C-N-CA 122.888 0.475 . . . . 0.0 111.413 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -55.21 -49.6 71.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.679 1.191 . . . . 0.0 110.616 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.21 -40.69 96.58 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 118.714 -0.66 . . . . 0.0 111.792 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -58.54 -52.74 64.38 Favored 'General case' 0 C--N 1.343 0.289 0 CA-C-N 118.909 0.777 . . . . 0.0 110.437 176.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -54.93 -52.4 63.07 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.54 1.136 . . . . 0.0 110.687 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -55.28 -55.82 27.08 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.54 0.736 . . . . 0.0 110.071 179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.0 -46.43 71.74 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.475 1.11 . . . . 0.0 111.561 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.02 -50.1 48.59 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.243 1.017 . . . . 0.0 109.966 177.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.1 m-70 -90.01 3.08 54.29 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.935 0.894 . . . . 0.0 113.031 -175.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -73.21 122.06 86.69 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 119.008 0.822 . . . . 0.0 110.89 -171.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -80.15 -28.47 3.07 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 123.256 2.637 . . . . 0.0 112.037 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -60.55 -47.07 87.82 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.185 0.994 . . . . 0.0 111.769 -171.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.9 mt -89.49 150.27 22.54 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.72 0.808 . . . . 0.0 109.541 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -89.46 -174.76 4.48 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.01 0.924 . . . . 0.0 109.274 175.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -51.39 -52.7 43.65 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.556 1.142 . . . . 0.0 111.911 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -65.69 -51.1 62.04 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 123.41 0.684 . . . . 0.0 111.054 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.75 -33.88 74.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.229 0.611 . . . . 0.0 111.251 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 48.8 ttp180 -61.2 -50.2 74.09 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.067 0.547 . . . . 0.0 109.794 172.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.43 -40.63 95.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.545 0.338 . . . . 0.0 111.006 179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.14 -46.72 85.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.646 0.778 . . . . 0.0 110.856 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 tppt? -59.07 -52.54 65.29 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.547 0.739 . . . . 0.0 110.113 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 15.0 mm -51.48 -58.17 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 123.84 0.856 . . . . 0.0 110.875 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -64.23 -35.7 81.69 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -174.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 91.7 p -63.89 -45.59 88.69 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.357 0.526 . . . . 0.0 110.668 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 39.8 mt -59.76 -48.04 89.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 119.013 -0.517 . . . . 0.0 109.635 175.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 41.3 mtm105 -57.89 -37.73 74.52 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-N 118.758 0.708 . . . . 0.0 111.934 177.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -67.05 -49.38 65.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 122.968 0.507 . . . . 0.0 109.868 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.27 -48.76 80.42 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.378 1.071 . . . . 0.0 111.131 178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.3 m -70.19 -36.18 74.45 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.139 1.376 . . . . 0.0 111.813 -177.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.065 0 O-C-N 122.031 -0.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 . . . . . 0 N--CA 1.469 0.524 0 CA-C-O 120.154 0.025 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -117.73 -61.9 1.63 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.172 1.389 . . . . 0.0 111.613 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 75.6 mtm -90.39 -127.68 0.08 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.298 1.039 . . . . 0.0 110.54 -173.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -56.49 -40.77 75.5 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 124.337 1.055 . . . . 0.0 111.318 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.5 m -53.67 -37.95 63.68 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.741 1.216 . . . . 0.0 112.225 177.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -61.38 -45.21 95.31 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 175.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -69.77 -34.06 73.25 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.393 0.677 . . . . 0.0 110.785 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 83.9 mtp180 -63.29 -49.24 74.8 Favored 'General case' 0 C--N 1.341 0.224 0 C-N-CA 123.529 0.732 . . . . 0.0 110.135 173.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -59.14 -46.09 89.27 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.691 0.396 . . . . 0.0 111.151 176.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -57.31 -50.68 72.17 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.441 1.097 . . . . 0.0 110.681 178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.91 -52.34 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.567 0.747 . . . . 0.0 110.686 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.67 -42.63 75.39 Favored 'General case' 0 C--N 1.338 0.106 0 C-N-CA 124.37 1.068 . . . . 0.0 111.597 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.5 tp -60.55 -51.96 67.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.688 0.795 . . . . 0.0 110.005 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.3 m-70 -91.57 62.98 4.65 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.777 0.831 . . . . 0.0 110.22 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -133.62 83.02 49.5 Favored Pre-proline 0 CA--C 1.536 0.44 0 C-N-CA 123.685 0.794 . . . . 0.0 109.47 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -51.38 -29.09 29.47 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 124.777 3.652 . . . . 0.0 114.798 -178.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -59.45 -29.68 67.97 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.794 0.838 . . . . 0.0 112.241 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.7 mt -89.51 165.1 14.5 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.338 0.655 . . . . 0.0 110.169 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -124.68 -165.58 1.4 Allowed 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.215 1.006 . . . . 0.0 109.281 169.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -47.01 -75.81 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.293 1.437 . . . . 0.0 113.526 -170.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -60.51 -40.44 91.45 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -57.17 -52.83 63.75 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.943 0.897 . . . . 0.0 110.882 176.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.5 ttm-85 -61.06 -52.6 64.28 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 123.958 0.903 . . . . 0.0 110.313 -178.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -56.55 -42.56 78.76 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 122.908 0.483 . . . . 0.0 111.194 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.79 85.19 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.11 0.564 . . . . 0.0 111.436 175.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -62.12 -48.34 80.59 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.704 0.802 . . . . 0.0 109.841 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.88 -37.26 71.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.661 0.784 . . . . 0.0 110.297 175.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -61.73 -52.0 66.05 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.083 0.953 . . . . 0.0 110.327 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -59.15 -43.11 92.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.683 178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.8 mt -60.58 -47.04 94.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 118.479 0.581 . . . . 0.0 109.931 176.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -55.13 -39.81 69.83 Favored 'General case' 0 C--N 1.342 0.267 0 CA-C-N 118.529 0.604 . . . . 0.0 111.904 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -67.64 -49.07 64.75 Favored 'General case' 0 C--N 1.339 0.139 0 CA-C-N 118.164 0.438 . . . . 0.0 110.14 -178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -60.36 -49.98 75.42 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.483 1.113 . . . . 0.0 111.248 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 95.1 m -75.22 -44.22 47.42 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.585 1.154 . . . . 0.0 111.472 -174.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.09 0 O-C-N 122.043 -0.411 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -168.26 -174.47 2.29 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.552 1.141 . . . . 0.0 109.295 -172.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 65.5 mtt -56.51 150.12 15.91 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.939 0.895 . . . . 0.0 110.435 176.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 76.57 -50.71 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.097 1.759 . . . . 0.0 111.454 -175.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.5 m -60.12 -55.47 33.43 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.532 0.605 . . . . 0.0 109.787 174.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -60.9 -37.9 83.84 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.502 0.721 . . . . 0.0 111.904 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.2 ttp85 -61.06 -49.72 76.2 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.54 0.736 . . . . 0.0 109.987 178.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.56 -37.2 86.01 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.536 0.735 . . . . 0.0 111.523 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -58.85 -54.77 43.37 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 118.771 0.714 . . . . 0.0 110.248 174.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -55.86 -49.04 74.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.941 1.296 . . . . 0.0 111.066 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -55.69 -53.43 56.62 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.829 1.252 . . . . 0.0 110.802 177.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.61 87.43 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.339 1.056 . . . . 0.0 111.478 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.35 -48.18 74.62 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.491 0.717 . . . . 0.0 109.316 175.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -94.68 41.74 1.09 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.81 0.844 . . . . 0.0 111.17 -177.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -117.77 90.47 36.28 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.215 1.006 . . . . 0.0 108.523 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.74 -25.57 20.28 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.042 2.494 . . . . 0.0 112.01 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -60.3 -35.79 76.39 Favored 'General case' 0 C--N 1.341 0.214 0 C-N-CA 123.778 0.831 . . . . 0.0 110.972 178.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.2 mt -89.37 140.01 29.94 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -89.08 -175.4 4.8 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.405 0.682 . . . . 0.0 109.658 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -51.42 -50.0 60.53 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.938 0.895 . . . . 0.0 111.471 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -63.4 -54.37 37.77 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.209 0.604 . . . . 0.0 111.199 -174.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -59.76 -45.33 92.57 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.63 0.772 . . . . 0.0 111.153 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -57.54 -56.53 20.69 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.003 0.921 . . . . 0.0 110.241 178.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.64 -42.38 88.15 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.581 . . . . 0.0 111.179 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.07 -48.16 82.59 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.973 0.509 . . . . 0.0 110.97 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.44 -50.49 73.52 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.927 0.891 . . . . 0.0 110.692 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.8 mm -51.74 -52.72 20.4 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 C-N-CA 124.146 0.978 . . . . 0.0 110.025 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -56.57 -49.1 75.86 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.166 0.586 . . . . 0.0 111.468 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -54.26 -51.51 64.3 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.985 0.514 . . . . 0.0 111.219 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.6 mt -60.03 -45.52 95.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.226 0.611 . . . . 0.0 110.053 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.8 mtp-105 -57.55 -39.61 77.03 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 123.22 0.608 . . . . 0.0 111.685 177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -69.2 -46.16 68.14 Favored 'General case' 0 C--N 1.339 0.132 0 C-N-CA 122.752 0.421 . . . . 0.0 109.883 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -58.85 -49.89 76.04 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.285 1.034 . . . . 0.0 111.075 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 99.0 m -73.37 -38.33 65.71 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.572 1.149 . . . . 0.0 111.703 -176.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.123 0 O-C-N 122.074 -0.391 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 111.278 0.103 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -162.18 -44.6 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.285 0.634 . . . . 0.0 111.541 -172.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.8 ptp -82.6 -161.15 0.44 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.685 1.194 . . . . 0.0 111.394 -174.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -46.79 -28.56 1.58 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.92 1.688 . . . . 0.0 113.779 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 69.6 m -46.12 -45.79 16.69 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.341 1.457 . . . . 0.0 111.473 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -56.42 -49.22 75.15 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.84 0.856 . . . . 0.0 111.622 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -65.94 -42.4 90.09 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.151 0.98 . . . . 0.0 109.604 -177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 65.4 mtp85 -60.85 -44.93 96.34 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.352 1.061 . . . . 0.0 110.983 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -60.39 -50.42 73.66 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.253 0.621 . . . . 0.0 110.344 176.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -54.84 -51.49 65.73 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.932 0.893 . . . . 0.0 110.805 179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -56.0 -54.48 44.3 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.757 0.823 . . . . 0.0 110.41 176.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.06 -40.68 73.93 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 124.391 1.076 . . . . 0.0 111.831 -178.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -52.18 66.78 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -89.8 51.47 2.09 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.956 0.902 . . . . 0.0 110.358 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -119.38 81.32 22.51 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 124.283 1.033 . . . . 0.0 109.458 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -72.2 -20.3 24.91 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 123.203 2.602 . . . . 0.0 111.886 177.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -60.86 -37.01 80.63 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 123.851 0.861 . . . . 0.0 110.866 177.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.5 mt -89.28 159.3 17.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 123.493 0.717 . . . . 0.0 109.413 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 49.5 p-10 -89.54 175.08 7.43 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 123.763 0.825 . . . . 0.0 108.81 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.38 -33.2 72.12 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.86 -63.2 1.38 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.806 0.843 . . . . 0.0 110.898 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.42 -35.47 81.03 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.805 0.442 . . . . 0.0 110.885 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.2 ttp-105 -61.2 -52.55 64.32 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.071 0.549 . . . . 0.0 111.108 177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -63.88 -38.35 90.77 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.731 0.696 . . . . 0.0 110.946 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -42.96 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.752 0.421 . . . . 0.0 110.821 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -61.07 -48.85 79.82 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.71 0.804 . . . . 0.0 110.387 177.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 26.9 mm -54.1 -49.64 60.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 123.426 0.691 . . . . 0.0 110.18 176.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -58.18 -42.67 86.59 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.739 0.816 . . . . 0.0 111.253 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -59.68 -48.63 80.91 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 122.865 0.466 . . . . 0.0 111.263 177.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.1 mt -59.15 -46.93 91.69 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 118.268 0.485 . . . . 0.0 109.971 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -61.31 -33.81 74.21 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.593 0.757 . . . . 0.0 111.815 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -70.83 -44.94 65.44 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.172 0.589 . . . . 0.0 110.143 175.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -58.47 -52.6 64.95 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.423 1.089 . . . . 0.0 110.716 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -47.83 68.28 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.818 0.447 . . . . 0.0 110.834 177.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.055 0 O-C-N 122.276 -0.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 44.2 p30 -163.28 169.91 18.43 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.677 1.191 . . . . 0.0 109.453 -173.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 82.0 mtp -81.92 60.52 4.81 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.611 0.764 . . . . 0.0 110.347 -177.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.446 ' O ' ' HG2' ' A' ' 13' ' ' ARG . 13.1 pt20 -163.66 -47.67 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.907 1.683 . . . . 0.0 109.112 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.5 m -68.93 -37.67 79.05 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 171.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -58.84 -42.63 89.74 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.835 0.454 . . . . 0.0 110.676 171.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 90.7 mtt-85 -63.25 -42.57 99.2 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 122.978 0.511 . . . . 0.0 110.416 177.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 9' ' ' GLN . 28.5 mmm180 -56.97 -51.12 70.49 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.052 0.541 . . . . 0.0 110.884 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -57.0 -52.62 64.56 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 122.571 0.348 . . . . 0.0 110.843 178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -51.3 -59.73 3.9 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.349 1.06 . . . . 0.0 110.81 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -54.75 -48.42 72.62 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.759 0.824 . . . . 0.0 111.243 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.09 -45.95 86.31 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.748 0.819 . . . . 0.0 112.212 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 44.5 mt -59.77 -39.91 86.47 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.081 0.952 . . . . 0.0 111.942 -179.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -89.2 -36.84 15.42 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.882 0.473 . . . . 0.0 111.543 -172.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -65.36 134.18 95.61 Favored Pre-proline 0 CA--C 1.532 0.253 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.6 -126.48 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.983 0 C-N-CA 122.945 2.43 . . . . 0.0 107.581 174.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 55.85 17.72 2.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.746 1.218 . . . . 0.0 113.289 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.3 mt -150.03 134.03 17.0 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.43 1.492 . . . . 0.0 107.64 -170.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.1 p30 -89.79 -176.36 4.93 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 169.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -57.79 -52.47 65.33 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.039 0.536 . . . . 0.0 111.195 -177.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -61.27 -53.33 58.21 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.289 0.636 . . . . 0.0 110.971 -174.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -62.39 -42.55 99.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.5 ttp85 -56.32 -61.46 2.39 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.013 0.525 . . . . 0.0 110.171 176.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -60.14 -35.87 76.24 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.251 -0.404 . . . . 0.0 111.986 -176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.69 -43.12 99.63 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.048 0.539 . . . . 0.0 111.295 175.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -69.64 -45.26 68.87 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.508 0.723 . . . . 0.0 110.162 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.7 mm -54.47 -48.12 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.045 0.938 . . . . 0.0 110.017 172.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -58.14 -45.41 87.42 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.836 0.854 . . . . 0.0 110.911 177.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -57.68 -48.4 79.65 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.939 0.496 . . . . 0.0 111.057 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -57.96 -52.63 55.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 C-N-CA 123.136 0.574 . . . . 0.0 109.64 176.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.9 ttp85 -57.28 -43.36 83.04 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.152 0.981 . . . . 0.0 112.065 -177.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.04 -47.86 73.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.391 0.677 . . . . 0.0 110.319 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -51.97 67.61 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.024 0.93 . . . . 0.0 111.374 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 72.4 m -69.53 -38.5 77.54 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.805 1.242 . . . . 0.0 111.282 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.099 0 O-C-N 122.199 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.499 0.185 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -159.27 178.32 10.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.849 0.86 . . . . 0.0 109.783 -178.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 79.5 mtm -43.63 -47.29 7.57 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.747 1.619 . . . . 0.0 112.764 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -69.13 -57.17 5.75 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.394 0.678 . . . . 0.0 111.329 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 m -61.72 -35.3 77.65 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.585 0.629 . . . . 0.0 111.862 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -59.89 -55.27 36.23 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.388 0.54 . . . . 0.0 111.678 174.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 20.0 ptp180 -65.67 -30.62 71.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.427 0.558 . . . . 0.0 111.882 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -65.69 -43.11 90.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.205 0.602 . . . . 0.0 110.798 174.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -59.63 -50.86 72.24 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.916 0.78 . . . . 0.0 110.348 174.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -54.75 -49.8 69.96 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.291 1.037 . . . . 0.0 110.637 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -55.81 -54.03 49.48 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.895 0.878 . . . . 0.0 110.354 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.88 -47.0 71.51 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.19 0.996 . . . . 0.0 112.166 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 28.6 mt -53.59 -39.4 64.83 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.983 0.913 . . . . 0.0 112.182 177.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -98.92 -20.07 17.0 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.79 0.836 . . . . 0.0 113.166 -169.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.76 122.95 79.77 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.414 0.686 . . . . 0.0 110.493 -173.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -73.49 -29.31 11.17 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.479 2.786 . . . . 0.0 112.668 -173.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -63.53 -28.3 69.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.464 0.705 . . . . 0.0 111.203 -179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.4 mt -89.63 128.48 36.06 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -88.8 -165.97 1.48 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 170.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -58.16 -51.32 70.21 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.918 0.487 . . . . 0.0 111.001 179.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -58.24 -57.29 13.51 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.15 0.98 . . . . 0.0 110.598 -177.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -56.48 -41.98 77.49 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 125.148 1.379 . . . . 0.0 110.881 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -62.87 -55.22 28.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.346 0.658 . . . . 0.0 109.995 -178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -58.07 -41.21 82.9 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.819 0.736 . . . . 0.0 111.326 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.85 -44.4 94.14 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.802 0.441 . . . . 0.0 111.204 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.44 -50.43 72.83 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.14 0.976 . . . . 0.0 110.472 178.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.1 mm -52.69 -49.36 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 C-N-CA 123.867 0.867 . . . . 0.0 110.084 175.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.5 -47.52 76.09 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.049 0.94 . . . . 0.0 110.94 178.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.5 m -60.76 -41.22 95.02 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.414 0.686 . . . . 0.0 112.027 178.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 50.5 mt -67.66 -49.62 68.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.368 0.667 . . . . 0.0 110.496 -177.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -65.62 -36.48 83.85 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 118.202 0.455 . . . . 0.0 111.7 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.19 -46.22 90.45 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.086 0.555 . . . . 0.0 110.602 172.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -58.16 -57.22 13.81 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.455 1.102 . . . . 0.0 111.595 -177.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 56.2 m -71.63 -34.97 70.24 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 117.914 0.325 . . . . 0.0 111.807 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.104 0 O-C-N 121.971 -0.456 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 111.629 0.233 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 16.2 p30 -170.2 169.01 8.01 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.784 1.234 . . . . 0.0 109.278 -173.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.0 mmt -81.81 57.59 3.49 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.188 0.995 . . . . 0.0 110.825 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -153.31 -53.82 0.11 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.23 1.812 . . . . 0.0 106.464 171.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.7 m -59.47 -43.86 93.16 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 124.082 0.953 . . . . 0.0 109.717 169.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -60.12 -43.79 95.38 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.125 0.57 . . . . 0.0 110.75 173.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.3 mmp_? -64.22 -37.6 88.07 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.187 0.595 . . . . 0.0 111.158 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -65.52 -46.38 79.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.119 0.968 . . . . 0.0 110.403 177.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.85 -54.79 42.94 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-N 118.285 0.493 . . . . 0.0 110.518 173.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -53.4 -48.4 68.72 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.777 1.631 . . . . 0.0 111.09 -177.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.09 -51.62 68.34 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.361 1.064 . . . . 0.0 110.782 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.98 -44.89 79.0 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.603 0.761 . . . . 0.0 111.512 -179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.6 mt -59.82 -52.71 64.28 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.823 0.849 . . . . 0.0 110.339 175.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -89.75 53.73 2.65 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.345 0.658 . . . . 0.0 110.501 -174.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -160.26 136.78 6.45 Favored Pre-proline 0 N--CA 1.453 -0.281 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -80.17 -129.09 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.845 2.363 . . . . 0.0 107.453 175.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 56.34 13.42 1.27 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.884 1.273 . . . . 0.0 113.429 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 58.5 mt -150.03 132.01 15.23 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.53 1.532 . . . . 0.0 107.392 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -89.8 -172.72 3.64 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -51.63 -52.56 46.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.374 0.669 . . . . 0.0 110.775 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -59.14 -56.83 17.1 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.701 0.8 . . . . 0.0 110.91 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -60.89 -40.46 93.16 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.898 0.879 . . . . 0.0 111.376 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.28 -57.3 13.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.569 0.748 . . . . 0.0 110.259 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -62.36 -35.7 79.95 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 119.468 -0.301 . . . . 0.0 111.256 -178.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.97 -43.76 98.16 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.16 0.584 . . . . 0.0 111.049 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -61.22 -50.69 72.07 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.596 0.758 . . . . 0.0 110.299 177.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.17 -47.84 76.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 122.831 0.452 . . . . 0.0 110.106 176.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.9 tttp -58.42 -44.34 89.03 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.346 0.658 . . . . 0.0 111.247 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.4 m -61.68 -48.31 81.4 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.586 0.754 . . . . 0.0 111.084 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 49.8 mt -60.64 -47.63 92.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 123.587 0.755 . . . . 0.0 109.834 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 51.4 ttm-85 -64.21 -39.83 94.79 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.218 1.007 . . . . 0.0 111.674 -177.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -65.0 -50.44 66.29 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.776 0.83 . . . . 0.0 110.355 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -55.76 -52.95 62.18 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.796 1.238 . . . . 0.0 111.216 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 94.9 m -70.83 -37.82 73.21 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.123 0.969 . . . . 0.0 111.733 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.093 0 O-C-N 122.094 -0.379 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 110.571 -0.159 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -74.57 178.59 5.24 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.928 0.491 . . . . 0.0 110.788 178.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.2 ptp -52.77 -41.36 64.01 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.752 0.821 . . . . 0.0 112.578 -178.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm100 -63.27 -43.83 96.82 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 118.193 0.451 . . . . 0.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.7 m -64.53 -45.56 86.66 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 122.93 0.492 . . . . 0.0 110.58 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -54.87 -54.46 42.18 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.689 0.796 . . . . 0.0 110.643 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -57.0 -42.71 80.79 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.88 1.272 . . . . 0.0 110.834 177.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.3 -51.32 70.43 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.135 0.974 . . . . 0.0 111.708 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -58.63 -52.47 65.55 Favored 'General case' 0 C--N 1.34 0.161 0 CA-C-N 118.068 0.395 . . . . 0.0 110.407 177.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.4 t80 -54.66 -51.3 65.9 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.186 0.994 . . . . 0.0 111.42 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -58.98 -53.38 59.04 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.618 1.167 . . . . 0.0 110.764 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.85 -39.19 90.97 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 123.88 0.872 . . . . 0.0 112.117 -177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.8 mt -57.83 -52.0 67.29 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.042 0.537 . . . . 0.0 109.721 173.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.32 0.648 . . . . 0.0 110.139 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -126.03 92.86 45.02 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.689 1.195 . . . . 0.0 108.509 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -72.81 -28.21 13.86 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.051 2.5 . . . . 0.0 111.92 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -60.59 -33.01 72.09 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.974 0.91 . . . . 0.0 111.2 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.13 137.18 32.55 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -88.77 172.72 9.02 Favored 'General case' 0 C--N 1.338 0.085 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -50.92 -41.16 58.53 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.323 0.649 . . . . 0.0 112.524 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.36 -62.38 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.188 0.595 . . . . 0.0 110.93 -176.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -64.65 -37.57 88.01 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.233 0.613 . . . . 0.0 111.012 -176.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -59.83 -54.67 43.55 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.959 0.904 . . . . 0.0 110.619 176.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -61.99 -40.53 95.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.163 0.438 . . . . 0.0 110.94 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.06 91.02 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.048 0.539 . . . . 0.0 110.916 175.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -50.61 70.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.809 0.444 . . . . 0.0 110.237 178.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.2 mm -53.24 -46.25 56.36 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 C-N-CA 124.177 0.991 . . . . 0.0 110.127 178.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -59.69 -46.99 87.4 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.586 0.754 . . . . 0.0 111.016 178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.2 t -61.92 -47.96 82.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.437 0.695 . . . . 0.0 111.282 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.75 -45.96 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 124.329 1.052 . . . . 0.0 109.125 177.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -64.08 -40.86 97.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.896 0.878 . . . . 0.0 111.598 -178.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.96 -48.6 81.04 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.264 0.626 . . . . 0.0 110.417 176.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -62.07 -51.62 67.2 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.786 0.834 . . . . 0.0 111.514 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 93.7 m -68.18 -35.04 77.39 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.185 1.394 . . . . 0.0 112.157 -175.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.091 0 O-C-N 122.017 -0.427 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 120.271 0.081 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -175.77 -173.71 0.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.304 1.442 . . . . 0.0 109.159 -169.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 86.8 mmm -61.55 -38.85 88.98 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.086 0.954 . . . . 0.0 112.37 -179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -61.86 -50.45 72.18 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -57.73 -43.48 85.33 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.02 0.928 . . . . 0.0 111.29 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -56.92 -50.97 70.96 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.718 0.807 . . . . 0.0 110.674 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -63.35 -38.64 91.94 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.749 0.82 . . . . 0.0 111.659 179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 55.7 mtp180 -62.03 -48.27 81.01 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.902 0.881 . . . . 0.0 110.458 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -57.88 -49.94 75.02 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.111 0.564 . . . . 0.0 111.031 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -57.64 -49.44 76.46 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.128 0.971 . . . . 0.0 110.883 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -55.92 -56.36 21.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.949 0.9 . . . . 0.0 110.15 176.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -40.65 76.86 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.186 0.994 . . . . 0.0 111.873 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.0 tp -60.09 -49.48 77.46 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.658 0.783 . . . . 0.0 109.812 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -93.39 58.44 2.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.75 0.82 . . . . 0.0 109.928 -178.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -129.11 86.89 55.78 Favored Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.803 0.841 . . . . 0.0 110.564 -178.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -58.57 -26.36 78.44 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 124.036 3.157 . . . . 0.0 113.318 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -55.39 -45.12 76.64 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 124.963 1.305 . . . . 0.0 111.855 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.0 mt -89.28 163.64 15.28 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 123.575 0.75 . . . . 0.0 109.644 176.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 p30 -89.41 -175.53 4.76 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.573 0.749 . . . . 0.0 109.37 174.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -63.3 -54.87 30.3 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 111.029 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -56.28 -52.86 62.95 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.567 0.747 . . . . 0.0 110.634 -179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.7 mm100 -60.65 -41.32 94.76 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.41 0.684 . . . . 0.0 111.981 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ttp-105 -64.44 -46.97 80.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.084 0.554 . . . . 0.0 110.873 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -61.52 -39.08 89.72 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.106 0.412 . . . . 0.0 110.88 176.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.87 -44.05 97.6 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.957 0.503 . . . . 0.0 110.859 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -58.93 -50.59 73.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.717 0.807 . . . . 0.0 110.507 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.0 mm -53.73 -47.75 61.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 C-N-CA 123.704 0.802 . . . . 0.0 110.17 175.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -60.08 -45.2 93.69 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.568 0.747 . . . . 0.0 111.328 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -60.75 -45.57 93.78 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.645 0.778 . . . . 0.0 111.197 178.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.8 mt -59.63 -47.33 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 123.426 0.691 . . . . 0.0 109.638 177.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -62.26 -43.29 99.16 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 123.613 0.765 . . . . 0.0 111.853 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.8 -50.82 70.79 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.842 0.857 . . . . 0.0 110.571 177.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -57.82 -53.51 57.41 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.643 1.177 . . . . 0.0 111.282 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 90.6 m -73.35 -29.44 62.65 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.33 1.052 . . . . 0.0 112.293 -175.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.098 0 O-C-N 121.863 -0.523 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 . . . . . 0 N--CA 1.474 0.764 0 CA-C-O 120.733 0.301 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -87.48 -175.93 5.41 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.887 0.875 . . . . 0.0 110.62 177.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.5 tpt -59.47 -39.01 82.31 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.73 0.812 . . . . 0.0 112.101 -177.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -56.52 -48.99 76.05 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.159 0.584 . . . . 0.0 110.135 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 96.2 m -68.84 -36.36 78.08 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.666 0.787 . . . . 0.0 111.732 -178.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.9 tm0? -56.0 -53.02 61.93 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.415 0.686 . . . . 0.0 109.995 170.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -59.16 -41.76 89.17 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.165 0.986 . . . . 0.0 111.395 179.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -61.48 -49.39 76.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.364 0.666 . . . . 0.0 111.009 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -56.23 -56.08 25.42 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.232 0.469 . . . . 0.0 110.391 176.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -53.33 -52.77 58.1 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 125.209 1.404 . . . . 0.0 110.917 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -54.73 -55.76 26.41 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.165 0.986 . . . . 0.0 110.292 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.81 -44.28 70.04 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.708 0.803 . . . . 0.0 111.853 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.56 -46.85 63.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.069 1.348 . . . . 0.0 110.679 178.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -89.73 -30.8 17.79 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.669 0.788 . . . . 0.0 112.782 -171.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -57.01 110.79 2.66 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 124.844 1.258 . . . . 0.0 111.926 -169.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.15 -22.44 22.47 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.055 2.503 . . . . 0.0 112.126 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -61.3 -27.61 68.6 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 123.19 0.596 . . . . 0.0 111.011 175.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -89.61 132.36 35.15 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 172.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.4 p30 -89.18 -174.18 4.32 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 171.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.56 -44.02 68.93 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.54 0.736 . . . . 0.0 112.672 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -64.57 -59.83 3.83 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.365 1.066 . . . . 0.0 109.954 -177.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -52.87 -46.68 68.0 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 124.927 1.291 . . . . 0.0 110.63 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 ttp-105 -61.97 -57.13 12.88 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.329 1.052 . . . . 0.0 111.327 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -61.22 -41.38 96.76 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.277 0.944 . . . . 0.0 111.077 -176.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.71 -46.56 81.19 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.419 0.688 . . . . 0.0 111.016 174.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -60.69 -48.48 81.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.094 0.958 . . . . 0.0 110.91 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.7 mm -55.06 -49.43 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 122.901 0.481 . . . . 0.0 110.0 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -59.85 -40.95 90.31 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.929 0.492 . . . . 0.0 111.87 177.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.5 m -60.74 -46.91 88.63 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.92 0.488 . . . . 0.0 110.821 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 33.1 mt -64.94 -41.19 91.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 C-N-CA 123.642 0.777 . . . . 0.0 109.766 178.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -57.12 -48.3 79.0 Favored 'General case' 0 C--N 1.34 0.192 0 C-N-CA 124.15 0.98 . . . . 0.0 110.565 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -63.76 -57.45 9.92 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.528 0.731 . . . . 0.0 110.635 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -50.25 -56.06 12.74 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.482 1.513 . . . . 0.0 111.977 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -91.87 10.82 27.12 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.664 1.185 . . . . 0.0 113.069 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.001 0 O-C-N 121.604 -0.685 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -72.08 169.11 16.71 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.811 0.444 . . . . 0.0 110.901 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -56.18 -42.67 77.46 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.92 0.888 . . . . 0.0 112.704 -175.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 -66.08 -49.3 68.08 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 122.766 0.426 . . . . 0.0 110.435 -176.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.8 m -58.21 -45.02 88.39 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.032 0.533 . . . . 0.0 110.411 175.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -58.53 -48.49 80.67 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.665 0.786 . . . . 0.0 111.412 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.1 mtp180 -55.81 -48.51 75.28 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.263 1.025 . . . . 0.0 110.57 175.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.2 mtp180 -60.35 -47.15 87.3 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.178 0.591 . . . . 0.0 111.244 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -57.52 -51.14 70.67 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 123.495 0.718 . . . . 0.0 110.552 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -54.78 -58.96 5.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.386 1.074 . . . . 0.0 110.619 179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -53.99 -51.11 64.98 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.53 0.732 . . . . 0.0 111.048 -179.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.76 -49.1 76.27 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.618 0.767 . . . . 0.0 111.509 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.8 tp -52.9 -43.14 65.96 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.67 1.188 . . . . 0.0 111.743 -178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.6 m-70 -89.71 -22.64 22.11 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.441 0.696 . . . . 0.0 112.602 -174.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.95 114.64 6.74 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 124.241 1.016 . . . . 0.0 111.097 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -76.81 -28.42 6.33 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 123.094 2.529 . . . . 0.0 111.934 -177.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -56.09 -42.26 76.47 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 124.821 1.249 . . . . 0.0 112.126 -173.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 79.3 mt -89.26 139.4 30.53 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -88.77 -177.69 5.59 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 124.023 0.929 . . . . 0.0 108.916 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -46.99 -51.95 15.91 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.793 0.837 . . . . 0.0 112.056 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -63.14 -56.47 16.5 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.082 0.401 . . . . 0.0 111.564 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -66.86 -43.29 83.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.287 0.635 . . . . 0.0 110.942 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.3 ttm180 -60.92 -49.46 77.37 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.832 0.853 . . . . 0.0 110.298 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.2 t-20 -63.42 -41.67 98.7 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.804 0.842 . . . . 0.0 110.258 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.85 -38.3 75.42 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.569 0.347 . . . . 0.0 111.178 172.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -62.36 -46.98 86.23 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 110.065 175.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 35.7 mm -55.55 -48.23 77.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.084 0.554 . . . . 0.0 110.151 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -57.37 -42.07 81.38 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.75 0.42 . . . . 0.0 111.383 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.0 m -62.19 -44.08 97.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.235 0.614 . . . . 0.0 111.465 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.66 -45.82 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -60.99 -38.17 85.03 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.671 0.788 . . . . 0.0 111.645 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -66.01 -47.63 73.84 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.453 0.701 . . . . 0.0 110.381 174.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -58.08 -54.6 45.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.4 1.08 . . . . 0.0 111.307 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -47.26 79.7 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.149 0.58 . . . . 0.0 111.553 176.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.113 0 O-C-N 122.311 -0.243 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -155.53 179.26 9.35 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.151 0.98 . . . . 0.0 110.194 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 40.9 tpp -58.31 -37.42 75.06 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.976 1.31 . . . . 0.0 111.749 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -62.51 -50.31 71.88 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.344 0.658 . . . . 0.0 110.591 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -56.7 -51.74 67.61 Favored 'General case' 0 C--N 1.34 0.154 0 C-N-CA 122.77 0.428 . . . . 0.0 111.442 174.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -50.84 -55.9 14.76 Favored 'General case' 0 C--N 1.339 0.147 0 C-N-CA 124.597 1.159 . . . . 0.0 110.82 -178.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -55.82 -53.9 51.08 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.57 0.748 . . . . 0.0 111.091 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -59.9 -45.5 92.36 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.888 -176.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -57.1 -56.85 16.41 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.135 0.574 . . . . 0.0 110.281 176.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -49.63 -56.75 8.93 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.89 1.276 . . . . 0.0 110.935 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -55.51 -51.11 68.09 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.998 0.919 . . . . 0.0 110.919 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.1 -44.48 87.69 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.619 0.768 . . . . 0.0 112.227 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.5 mt -58.33 -44.67 88.78 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 124.009 0.924 . . . . 0.0 111.837 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -89.35 -43.61 10.79 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.874 0.47 . . . . 0.0 111.749 -170.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -59.84 136.27 90.15 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 109.744 -178.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.54 -127.5 0.01 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.864 2.376 . . . . 0.0 107.717 174.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 54.72 15.62 1.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.787 1.235 . . . . 0.0 113.49 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.5 mt -150.0 133.18 16.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.431 1.493 . . . . 0.0 107.635 -170.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -89.41 170.79 10.23 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 170.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -48.43 -57.41 6.12 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.282 1.033 . . . . 0.0 112.302 -173.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -57.45 -48.61 78.72 Favored 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 123.576 0.75 . . . . 0.0 111.35 -175.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -68.54 -35.08 76.94 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.678 0.791 . . . . 0.0 111.533 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -67.33 -48.27 68.04 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.162 0.437 . . . . 0.0 109.859 177.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -59.42 -39.87 84.9 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.615 0.366 . . . . 0.0 111.019 174.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.05 -39.97 94.17 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 122.972 0.509 . . . . 0.0 111.303 176.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.5 -50.74 71.49 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.449 0.7 . . . . 0.0 110.196 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 46.8 mm -55.01 -48.64 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 122.99 0.516 . . . . 0.0 110.388 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -58.71 -45.45 89.51 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.014 0.526 . . . . 0.0 111.197 178.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.5 t -59.24 -46.74 87.68 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.629 0.771 . . . . 0.0 111.023 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.9 mt -61.09 -49.3 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 123.983 0.913 . . . . 0.0 109.945 177.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -57.19 -39.45 75.41 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.876 1.271 . . . . 0.0 111.953 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.67 -45.82 67.5 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.118 0.567 . . . . 0.0 110.344 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.89 -51.46 67.5 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.56 1.144 . . . . 0.0 111.054 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.43 -47.16 64.95 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.338 0.655 . . . . 0.0 110.39 178.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.079 0 CA-C-N 116.733 -0.212 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 111.477 0.176 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -161.38 169.11 22.61 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 124.335 1.054 . . . . 0.0 109.807 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -46.35 -44.24 16.75 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.447 1.499 . . . . 0.0 114.047 -173.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -65.36 -41.59 93.68 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.385 0.539 . . . . 0.0 110.68 -178.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 m -64.74 -49.11 72.11 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.349 0.66 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -61.13 -44.55 97.16 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.914 0.486 . . . . 0.0 111.217 179.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.0 ttm180 -55.17 -51.01 67.85 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.806 1.242 . . . . 0.0 110.56 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -66.46 -38.97 88.52 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 118.84 -0.6 . . . . 0.0 111.718 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -58.19 -56.61 19.88 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.848 0.749 . . . . 0.0 110.01 174.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -51.81 -50.74 60.23 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.34 1.456 . . . . 0.0 110.743 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -55.96 -55.17 35.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.739 0.816 . . . . 0.0 110.665 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.23 -39.62 75.91 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.988 0.915 . . . . 0.0 112.121 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.43 -47.71 78.52 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.79 1.236 . . . . 0.0 110.489 179.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -89.36 -30.59 18.29 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.484 0.714 . . . . 0.0 111.912 -171.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.11 123.9 67.29 Favored Pre-proline 0 N--CA 1.454 -0.242 0 C-N-CA 124.648 1.179 . . . . 0.0 109.684 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -79.96 -135.98 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.161 0 C-N-CA 122.961 2.441 . . . . 0.0 106.151 170.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 22.6 m120 70.18 -52.24 0.64 Allowed 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 126.183 1.793 . . . . 0.0 112.407 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.2 mt -88.88 151.7 22.18 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 126.269 1.828 . . . . 0.0 108.552 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -89.47 -174.64 4.43 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 172.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -58.18 -46.46 85.71 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.795 0.838 . . . . 0.0 111.717 -175.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -64.57 -48.86 73.43 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 122.724 0.41 . . . . 0.0 110.879 -176.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -67.5 -35.09 78.46 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.166 0.586 . . . . 0.0 111.51 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -61.06 -51.4 69.32 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 172.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -59.94 -37.06 78.41 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.992 0.517 . . . . 0.0 111.122 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.44 -43.29 97.84 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.402 0.681 . . . . 0.0 110.948 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -59.57 -52.09 67.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.466 0.707 . . . . 0.0 110.253 176.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.6 mm -52.96 -51.09 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.109 0.564 . . . . 0.0 109.98 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -57.33 -46.07 83.62 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.535 1.134 . . . . 0.0 111.656 -178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.7 p -64.41 -38.14 89.98 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.136 0.426 . . . . 0.0 111.672 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.69 -45.34 84.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 176.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.16 -40.91 82.62 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 123.557 0.743 . . . . 0.0 111.097 176.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -64.87 -51.18 63.39 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.515 0.726 . . . . 0.0 110.582 177.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.69 -50.32 66.12 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.076 1.351 . . . . 0.0 111.272 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 78.1 m -74.73 -38.79 62.19 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.433 1.093 . . . . 0.0 111.777 -176.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.132 0 O-C-N 122.209 -0.307 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.738 0.304 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -95.79 -57.06 2.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.475 1.11 . . . . 0.0 113.456 -169.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.1 tpt -90.8 -100.24 0.11 Allowed 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.403 0.681 . . . . 0.0 110.82 -171.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -76.06 -22.78 55.29 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.683 0.793 . . . . 0.0 111.848 -169.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 58.6 m -59.6 -55.57 32.82 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.372 1.069 . . . . 0.0 110.686 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -67.88 -34.55 76.89 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -61.09 -47.86 84.35 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.929 0.492 . . . . 0.0 109.865 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -64.34 -41.49 96.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 118.495 -0.765 . . . . 0.0 111.393 176.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.18 -52.02 64.67 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 119.083 0.856 . . . . 0.0 110.341 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -55.46 -57.45 11.85 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.613 1.165 . . . . 0.0 110.696 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -54.18 -51.55 64.0 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.175 0.59 . . . . 0.0 111.102 -179.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.55 -46.87 85.94 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.692 0.797 . . . . 0.0 111.649 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.27 -43.49 67.49 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.747 1.219 . . . . 0.0 111.47 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.1 m-70 -89.54 -19.24 25.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.18 0.592 . . . . 0.0 112.31 -175.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -59.33 120.01 44.32 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 123.535 0.734 . . . . 0.0 110.783 -179.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -81.17 -28.96 2.17 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 123.444 2.763 . . . . 0.0 111.955 -179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -55.89 -40.98 73.77 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.697 -174.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.0 mt -89.17 130.55 35.58 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 172.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -89.0 -178.82 5.79 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 178.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -41.4 -63.89 0.64 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.193 1.397 . . . . 0.0 113.528 -171.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.11 -44.65 91.62 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -172.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -64.85 -44.87 88.38 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.785 0.834 . . . . 0.0 110.645 -178.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp180 -63.21 -47.61 81.8 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.483 1.513 . . . . 0.0 110.378 179.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -59.65 -42.34 92.55 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.382 0.673 . . . . 0.0 110.674 176.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.5 -38.05 85.91 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.623 0.369 . . . . 0.0 111.084 174.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -62.1 -49.98 73.77 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.673 0.789 . . . . 0.0 109.988 177.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 34.4 mm -53.62 -47.43 61.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.833 0.853 . . . . 0.0 110.221 174.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 20.9 ttmm -56.93 -46.27 82.16 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.874 0.87 . . . . 0.0 110.927 178.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.0 m -60.81 -41.3 95.43 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.626 0.77 . . . . 0.0 111.779 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 46.8 mt -63.23 -52.11 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 118.15 0.432 . . . . 0.0 110.284 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -67.99 -33.79 75.3 Favored 'General case' 0 C--N 1.339 0.134 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.12 -51.63 68.77 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.361 0.664 . . . . 0.0 110.496 172.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -56.98 -51.28 69.83 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.961 1.304 . . . . 0.0 111.094 178.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 65.6 m -65.67 -44.42 86.33 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.369 1.067 . . . . 0.0 111.769 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.163 0 O-C-N 122.193 -0.317 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.67 173.39 3.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.514 1.126 . . . . 0.0 111.06 174.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.44 166.32 3.15 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.15 0.58 . . . . 0.0 111.628 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 70.4 -59.89 0.51 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.966 2.106 . . . . 0.0 110.659 -171.383 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.2 m -54.9 -54.3 44.39 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.636 0.774 . . . . 0.0 109.165 170.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -53.4 -41.46 65.99 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.371 1.068 . . . . 0.0 111.593 177.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -64.34 -49.1 73.03 Favored 'General case' 0 C--N 1.339 0.141 0 C-N-CA 122.674 0.39 . . . . 0.0 110.762 179.689 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 87.4 mtm-85 -57.88 -47.08 83.79 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.037 177.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -55.7 -57.87 10.19 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.946 0.498 . . . . 0.0 110.91 175.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -50.37 -58.79 4.9 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.425 1.49 . . . . 0.0 111.19 -178.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -56.75 -51.28 69.47 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.548 0.739 . . . . 0.0 110.899 -178.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.39 -41.54 72.8 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.401 0.68 . . . . 0.0 112.002 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -57.26 -48.26 79.32 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.273 1.029 . . . . 0.0 110.46 178.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -89.09 -23.88 22.41 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -169.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.59 123.24 70.04 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 118.525 0.602 . . . . 0.0 111.002 -172.628 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.13 -30.89 6.5 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.436 2.757 . . . . 0.0 112.37 -174.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -63.09 -27.51 69.44 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.603 0.761 . . . . 0.0 111.345 -179.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 mp -88.94 125.68 35.06 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 172.581 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 36.6 p-10 -88.9 -172.13 3.57 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 175.593 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.16 -42.22 65.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.997 0.519 . . . . 0.0 112.01 178.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -65.03 -60.85 2.58 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 123.675 0.79 . . . . 0.0 110.886 -176.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -60.32 -39.72 88.01 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.38 0.672 . . . . 0.0 110.536 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.7 ttp85 -58.69 -61.13 2.84 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.754 0.822 . . . . 0.0 110.263 177.802 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -61.01 -38.5 86.29 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 119.123 0.874 . . . . 0.0 111.439 -174.693 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.28 -43.78 92.52 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.677 0.791 . . . . 0.0 111.347 174.607 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.49 -49.23 69.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.495 0.718 . . . . 0.0 110.556 178.646 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 31.0 mm -56.02 -40.81 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.95 0.9 . . . . 0.0 109.996 176.471 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.0 ttmm -62.32 -48.33 80.32 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.517 0.727 . . . . 0.0 110.852 175.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.4 m -56.53 -48.74 76.61 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.089 0.556 . . . . 0.0 111.005 178.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.0 mt -64.67 -39.94 87.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.01 0.524 . . . . 0.0 109.982 -178.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -57.16 -41.3 78.92 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.962 0.801 . . . . 0.0 111.538 172.217 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -67.78 -43.77 78.99 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.078 0.399 . . . . 0.0 110.11 -178.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -64.4 -58.05 7.57 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.557 1.143 . . . . 0.0 111.237 -179.286 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 85.7 m -76.48 -41.01 48.63 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.729 1.212 . . . . 0.0 111.599 -173.29 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.07 0 O-C-N 122.039 -0.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -161.91 -174.02 3.96 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.886 1.274 . . . . 0.0 109.351 -179.345 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.4 ppp? -51.81 -36.65 48.7 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.355 1.062 . . . . 0.0 112.931 179.0 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.6 tp60 -65.3 -44.66 87.22 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.963 0.505 . . . . 0.0 110.653 179.08 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.2 m -64.39 -42.44 96.13 Favored 'General case' 0 C--N 1.338 0.08 0 C-N-CA 123.438 0.695 . . . . 0.0 110.666 177.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -57.78 -48.54 79.38 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.685 0.794 . . . . 0.0 110.569 175.778 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -58.41 -46.41 86.49 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.023 0.929 . . . . 0.0 111.251 176.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 -59.77 -47.76 84.38 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.46 0.704 . . . . 0.0 111.119 179.357 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -58.03 -56.51 21.13 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 122.916 0.486 . . . . 0.0 110.468 176.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -50.44 -51.58 45.41 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.58 1.152 . . . . 0.0 110.9 -179.312 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -56.39 -57.95 10.09 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.782 0.833 . . . . 0.0 110.514 178.013 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.92 -44.65 74.43 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.093 0.957 . . . . 0.0 112.381 -176.408 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.5 mt -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.066 0.947 . . . . 0.0 111.583 178.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.5 m-70 -89.67 -23.15 21.94 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.242 0.617 . . . . 0.0 112.284 -172.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -60.79 126.4 85.3 Favored Pre-proline 0 CA--C 1.532 0.275 0 C-N-CA 124.194 0.997 . . . . 0.0 109.828 179.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.16 -129.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 123.1 2.533 . . . . 0.0 106.428 170.799 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.1 m120 70.42 -55.76 0.61 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.45 1.9 . . . . 0.0 113.472 175.361 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.3 mt -88.85 166.42 14.0 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 126.104 1.762 . . . . 0.0 109.193 -177.016 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -89.6 -177.8 5.39 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.039 0.536 . . . . 0.0 109.566 171.448 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -60.56 -55.32 34.82 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.072 0.949 . . . . 0.0 110.853 -175.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -58.8 -49.05 79.14 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.942 0.897 . . . . 0.0 111.34 -176.65 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -59.88 -46.12 90.33 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.984 0.514 . . . . 0.0 111.232 178.526 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.8 ttp-105 -64.31 -50.69 66.83 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 122.955 0.502 . . . . 0.0 111.645 -178.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -63.93 -39.05 93.26 Favored 'General case' 0 C--N 1.34 0.192 0 CA-C-N 118.708 0.685 . . . . 0.0 111.57 179.325 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.62 -38.16 69.13 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.976 0.51 . . . . 0.0 110.987 171.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -62.12 -45.62 92.68 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.468 0.707 . . . . 0.0 110.366 174.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.6 mm -56.64 -48.53 80.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 122.966 0.506 . . . . 0.0 110.221 175.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -56.62 -46.18 81.08 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.001 0.52 . . . . 0.0 110.876 176.616 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.7 m -58.06 -47.62 82.61 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.57 0.748 . . . . 0.0 111.623 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -58.54 -49.44 82.34 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 176.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -61.82 -41.23 97.52 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.672 0.789 . . . . 0.0 111.984 -176.419 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -63.89 -52.1 61.49 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 124.079 0.952 . . . . 0.0 110.396 176.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.86 -51.96 65.73 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.638 1.175 . . . . 0.0 111.443 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 97.8 m -75.65 -29.96 59.29 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.654 1.181 . . . . 0.0 112.234 -175.365 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.07 0 O-C-N 122.003 -0.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 . . . . . 0 N--CA 1.474 0.732 0 CA-C-O 119.593 -0.241 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -89.13 -175.23 4.73 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.598 0.759 . . . . 0.0 109.665 174.03 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.4 tpt -45.7 -47.14 15.21 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.183 1.393 . . . . 0.0 111.796 177.456 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -71.05 -63.85 1.02 Allowed 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.007 0.923 . . . . 0.0 110.374 -178.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 93.1 m -60.57 -38.55 84.93 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.246 1.018 . . . . 0.0 112.37 -170.212 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -51.39 -52.74 43.23 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.612 0.765 . . . . 0.0 110.221 173.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -67.58 -36.44 80.91 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.785 0.834 . . . . 0.0 111.443 -177.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -60.44 -52.85 63.47 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 175.507 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -57.98 -52.38 65.77 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.224 0.609 . . . . 0.0 110.973 178.516 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -55.24 -51.61 66.03 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.882 1.273 . . . . 0.0 111.074 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -57.35 -51.69 68.36 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.959 0.904 . . . . 0.0 110.642 178.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.52 -39.52 76.73 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.87 0.868 . . . . 0.0 111.89 179.668 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -51.21 70.55 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 175.618 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -89.55 53.34 2.57 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.561 0.744 . . . . 0.0 110.139 -176.472 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -129.84 77.07 77.44 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.366 1.067 . . . . 0.0 109.051 179.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -70.05 -14.78 35.59 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.441 2.761 . . . . 0.0 112.463 -179.395 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -59.46 -36.26 75.63 Favored 'General case' 0 C--N 1.341 0.234 0 C-N-CA 123.46 0.704 . . . . 0.0 110.047 173.08 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 84.4 mt -89.34 146.31 24.78 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.243 1.017 . . . . 0.0 108.279 172.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -88.65 179.93 6.16 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.7 tm-20 -47.77 -51.32 22.82 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.853 1.261 . . . . 0.0 111.754 -178.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -60.02 -59.28 5.68 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.361 1.064 . . . . 0.0 111.16 -177.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -55.06 -43.19 73.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.36 1.064 . . . . 0.0 111.29 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.8 ttp180 -64.82 -50.62 65.98 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.345 1.058 . . . . 0.0 111.101 -177.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -63.49 -40.14 96.3 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-N 118.977 0.808 . . . . 0.0 111.352 178.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.38 -43.59 88.55 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.443 0.697 . . . . 0.0 110.942 175.711 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -63.02 -47.86 81.22 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.894 0.877 . . . . 0.0 110.588 177.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.1 mm -54.47 -47.46 70.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.146 0.578 . . . . 0.0 110.525 175.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -61.51 -43.51 98.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.568 0.747 . . . . 0.0 111.363 178.724 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.6 m -60.31 -49.24 78.37 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 123.214 0.606 . . . . 0.0 110.684 178.232 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.1 mt -57.04 -44.77 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 123.626 0.771 . . . . 0.0 109.38 175.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -64.0 -34.72 78.64 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.309 0.644 . . . . 0.0 111.953 -178.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -68.41 -47.86 66.16 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.142 0.577 . . . . 0.0 109.855 176.602 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -59.1 -49.81 76.46 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.235 1.014 . . . . 0.0 111.146 178.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 84.3 m -72.97 -44.25 61.31 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.279 1.432 . . . . 0.0 111.407 -175.138 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.055 0 O-C-N 122.054 -0.404 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 . . . . . 0 N--CA 1.475 0.802 0 CA-C-O 120.642 0.258 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.4 p-10 -106.12 -166.69 1.22 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.148 1.379 . . . . 0.0 110.738 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.0 tpt -60.83 -40.84 94.3 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.777 0.831 . . . . 0.0 111.26 177.595 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -61.34 -42.02 97.99 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.849 0.46 . . . . 0.0 110.971 177.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 90.8 m -63.48 -44.28 94.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.032 0.533 . . . . 0.0 110.762 176.147 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -58.26 -49.8 75.83 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.879 0.472 . . . . 0.0 110.882 177.004 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -54.19 -51.82 63.16 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.336 1.055 . . . . 0.0 110.506 175.265 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -52.79 -48.89 66.54 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.914 1.285 . . . . 0.0 111.391 179.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -60.9 -53.21 60.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 122.519 0.328 . . . . 0.0 111.178 176.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -54.13 -58.84 5.83 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.994 0.918 . . . . 0.0 111.077 -176.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.41 -45.16 94.6 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.567 -176.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.67 -45.99 92.05 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 118.266 0.484 . . . . 0.0 111.455 179.133 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.25 -46.18 79.73 Favored 'General case' 0 C--N 1.339 0.131 0 C-N-CA 124.743 1.217 . . . . 0.0 111.473 -178.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -89.2 -28.56 19.89 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.059 0.544 . . . . 0.0 111.808 -171.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -58.88 122.07 59.45 Favored Pre-proline 0 CA--C 1.532 0.277 0 C-N-CA 123.674 0.79 . . . . 0.0 110.175 177.095 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -80.94 -132.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.097 0 C-N-CA 123.106 2.537 . . . . 0.0 106.106 169.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 70.55 -50.95 0.67 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.431 1.892 . . . . 0.0 113.073 179.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.1 mt -88.77 162.04 16.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.883 1.673 . . . . 0.0 108.554 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -90.07 178.64 6.14 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.928 0.394 . . . . 0.0 110.579 175.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -58.05 -41.09 82.54 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.925 0.89 . . . . 0.0 111.394 179.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.16 -58.06 10.32 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 123.35 0.66 . . . . 0.0 110.573 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -55.56 -49.94 71.36 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.828 1.251 . . . . 0.0 110.897 179.132 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 ttp-105 -67.42 -42.41 83.24 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.439 0.695 . . . . 0.0 112.137 -173.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -70.88 -39.18 72.98 Favored 'General case' 0 C--N 1.341 0.212 0 CA-C-N 118.937 0.789 . . . . 0.0 110.543 178.48 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.2 -40.26 89.47 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.631 0.773 . . . . 0.0 111.298 175.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.0 tptt -58.97 -51.98 67.73 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.67 0.788 . . . . 0.0 109.758 174.223 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 7.8 mt -57.5 -40.74 76.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 118.202 0.455 . . . . 0.0 111.52 176.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -61.02 -42.98 99.5 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.693 0.679 . . . . 0.0 110.824 176.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 36.6 m -64.02 -44.36 92.81 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.632 0.773 . . . . 0.0 111.014 178.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.6 mt -62.15 -49.23 84.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.2 mtp-105 -52.66 -50.1 63.9 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 123.97 0.908 . . . . 0.0 111.327 175.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -58.97 -50.51 73.79 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.525 0.73 . . . . 0.0 111.023 -178.703 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -61.64 -52.21 65.29 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.37 1.068 . . . . 0.0 111.508 -179.19 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 88.1 m -71.91 -30.52 65.45 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 125.238 1.415 . . . . 0.0 112.264 -173.786 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.077 0 O-C-N 122.141 -0.349 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_